BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID of Ligand PubChem SID of Ligand ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence PDB ID(s) of Target Chain UniProt (SwissProt) Recommended Name of Target Chain UniProt (SwissProt) Entry Name of Target Chain UniProt (SwissProt) Primary ID of Target Chain UniProt (SwissProt) Secondary ID(s) of Target Chain UniProt (SwissProt) Alternative ID(s) of Target Chain UniProt (TrEMBL) Submitted Name of Target Chain UniProt (TrEMBL) Entry Name of Target Chain UniProt (TrEMBL) Primary ID of Target Chain UniProt (TrEMBL) Secondary ID(s) of Target Chain UniProt (TrEMBL) Alternative ID(s) of Target Chain 50004784 CC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C34H49N5O5S/c1-24(37-33(42)30(23-26-12-6-3-7-13-26)44-34(43)39-19-15-27(35)16-20-39)32(41)38-28(22-25-10-4-2-5-11-25)29(40)17-21-45-31-14-8-9-18-36-31/h3,6-9,12-14,18,24-25,27-30,40H,2,4-5,10-11,15-17,19-23,35H2,1H3,(H,37,42)(H,38,41)/t24?,28-,29-,30-/m0/s1 FYDPHJLAPZGAEJ-WBUPHKQUSA-N 50002971 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL119293 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002971&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44345110 103917012 CHEMBL119293 ZINC27104893 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004785 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccncc1 InChI=1S/C35H51N5O5S2/c1-46-24-30(39-34(43)32(23-26-10-6-3-7-11-26)45-35(44)40-19-14-27(36)15-20-40)33(42)38-29(22-25-8-4-2-5-9-25)31(41)16-21-47-28-12-17-37-18-13-28/h3,6-7,10-13,17-18,25,27,29-32,41H,2,4-5,8-9,14-16,19-24,36H2,1H3,(H,38,42)(H,39,43)/t29-,30-,31-,32-/m0/s1 GBZJUXXQDANXHV-YDPTYEFTSA-N 50002973 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-4-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL330783 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002973&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 11765175 103917014 CHEMBL330783 C03800 ZINC27104885 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004790 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)COc1ccncc1 InChI=1S/C34H49N5O6S/c1-46-23-29(32(41)37-28(20-24-8-4-2-5-9-24)30(40)22-44-27-12-16-36-17-13-27)38-33(42)31(21-25-10-6-3-7-11-25)45-34(43)39-18-14-26(35)15-19-39/h3,6-7,10-13,16-17,24,26,28-31,40H,2,4-5,8-9,14-15,18-23,35H2,1H3,(H,37,41)(H,38,42)/t28-,29-,30-,31-/m0/s1 KLENYDNRGAWIAG-ORYMTKCHSA-N 50002976 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-3-(pyridin-4-yloxy)-propylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL118719 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002976&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search M90 1E82 5288847 103917017 CHEMBL118719 C03800 ZINC27108570 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004793 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1nnnn1C InChI=1S/C32H50N8O5S2/c1-39-31(36-37-38-39)47-18-15-27(41)25(19-22-9-5-3-6-10-22)34-29(42)26(21-46-2)35-30(43)28(20-23-11-7-4-8-12-23)45-32(44)40-16-13-24(33)14-17-40/h4,7-8,11-12,22,24-28,41H,3,5-6,9-10,13-21,33H2,1-2H3,(H,34,42)(H,35,43)/t25-,26-,27-,28-/m0/s1 CEVZFFRSTOBDSX-LJWNLINESA-N 50002979 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(1-methyl-1H-tetrazol-5-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL421050 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002979&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10078377 103917020 CHEMBL421050 C03800 ZINC27108777 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004797 CCCCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C37H55N5O5S/c1-2-3-16-30(40-36(45)33(26-28-14-8-5-9-15-28)47-37(46)42-22-18-29(38)19-23-42)35(44)41-31(25-27-12-6-4-7-13-27)32(43)20-24-48-34-17-10-11-21-39-34/h5,8-11,14-15,17,21,27,29-33,43H,2-4,6-7,12-13,16,18-20,22-26,38H2,1H3,(H,40,45)(H,41,44)/t30?,31-,32-,33-/m0/s1 XLLDPLOTIOIWDK-UCJDAUIDSA-N 50002980 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-3-methyl-butylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL118686 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002980 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002980&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44344981 103917021 CHEMBL118686 ZINC27106202 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004799 CC(C)CC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C37H55N5O5S/c1-26(2)23-31(41-36(45)33(25-28-13-7-4-8-14-28)47-37(46)42-20-16-29(38)17-21-42)35(44)40-30(24-27-11-5-3-6-12-27)32(43)18-22-48-34-15-9-10-19-39-34/h4,7-10,13-15,19,26-27,29-33,43H,3,5-6,11-12,16-18,20-25,38H2,1-2H3,(H,40,44)(H,41,45)/t30-,31?,32-,33-/m0/s1 JKPVPRNBQSDFKM-NROWOOLRSA-N 50002983 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-3-methyl-butylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL116823 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002983 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002983&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44345011 103917024 CHEMBL116823 ZINC27106872 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004801 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)Cn1ccc(=O)cc1 InChI=1S/C34H49N5O6S/c1-46-23-29(32(42)36-28(20-24-8-4-2-5-9-24)30(41)22-38-16-14-27(40)15-17-38)37-33(43)31(21-25-10-6-3-7-11-25)45-34(44)39-18-12-26(35)13-19-39/h3,6-7,10-11,14-17,24,26,28-31,41H,2,4-5,8-9,12-13,18-23,35H2,1H3,(H,36,42)(H,37,43)/t28-,29-,30-,31-/m0/s1 RWNFORGFQCZXSD-ORYMTKCHSA-N 50002981 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-3-(4-oxo-4H-pyridin-1-yl)-propylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL117002 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002981 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002981&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10032270 103917022 CHEMBL117002 C03800 ZINC27108384 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004803 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1nccs1 InChI=1S/C33H49N5O5S3/c1-44-22-27(30(40)36-26(20-23-8-4-2-5-9-23)28(39)14-18-45-32-35-15-19-46-32)37-31(41)29(21-24-10-6-3-7-11-24)43-33(42)38-16-12-25(34)13-17-38/h3,6-7,10-11,15,19,23,25-29,39H,2,4-5,8-9,12-14,16-18,20-22,34H2,1H3,(H,36,40)(H,37,41)/t26-,27-,28-,29-/m0/s1 FPMGNJVZWARWBM-DZUOILHNSA-N 50002985 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(thiazol-2-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL445901 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002985 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002985&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10439647 103917026 CHEMBL445901 C03800 ZINC27105974 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004806 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CSc1ccccn1 InChI=1S/C34H49N5O5S2/c1-45-22-28(32(41)37-27(20-24-10-4-2-5-11-24)29(40)23-46-31-14-8-9-17-36-31)38-33(42)30(21-25-12-6-3-7-13-25)44-34(43)39-18-15-26(35)16-19-39/h3,6-9,12-14,17,24,26-30,40H,2,4-5,10-11,15-16,18-23,35H2,1H3,(H,37,41)(H,38,42)/t27-,28-,29-,30-/m0/s1 XONVKFCNVZUDTQ-KRCBVYEFSA-N 50002967 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-3-(pyridin-2-ylsulfanyl)-propylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL116483 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002967&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10394708 103917008 CHEMBL116483 C03800 ZINC27107907 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004811 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)Cn1ccccc1=O InChI=1S/C34H49N5O6S/c1-46-23-28(32(42)36-27(20-24-10-4-2-5-11-24)29(40)22-39-17-9-8-14-31(39)41)37-33(43)30(21-25-12-6-3-7-13-25)45-34(44)38-18-15-26(35)16-19-38/h3,6-9,12-14,17,24,26-30,40H,2,4-5,10-11,15-16,18-23,35H2,1H3,(H,36,42)(H,37,43)/t27-,28-,29-,30-/m0/s1 HYLLVLPQGWZUHR-KRCBVYEFSA-N 50002972 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-3-(2-oxo-2H-pyridin-1-yl)-propylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL116427 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002972&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search M91 1E81 5288846 103917013 CHEMBL116427 C03800 ZINC27105955 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004814 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1nnc(C)s1 InChI=1S/C33H50N6O5S3/c1-22-37-38-32(47-22)46-18-15-28(40)26(19-23-9-5-3-6-10-23)35-30(41)27(21-45-2)36-31(42)29(20-24-11-7-4-8-12-24)44-33(43)39-16-13-25(34)14-17-39/h4,7-8,11-12,23,25-29,40H,3,5-6,9-10,13-21,34H2,1-2H3,(H,35,41)(H,36,42)/t26-,27-,28-,29-/m0/s1 NLDDSFIWYIFSEC-DZUOILHNSA-N 50002977 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(5-methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL327069 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002977&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10078482 103917018 CHEMBL327069 C03800 ZINC27102146 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004817 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CSc1nnc[nH]1 InChI=1S/C31H47N7O5S2/c1-44-18-25(28(40)35-24(16-21-8-4-2-5-9-21)26(39)19-45-30-33-20-34-37-30)36-29(41)27(17-22-10-6-3-7-11-22)43-31(42)38-14-12-23(32)13-15-38/h3,6-7,10-11,20-21,23-27,39H,2,4-5,8-9,12-19,32H2,1H3,(H,35,40)(H,36,41)(H,33,34,37)/t24-,25-,26-,27-/m0/s1 PDNQJHCIOPMOOL-FWEHEUNISA-N 50002992 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-3-(1H-[1,2,4]triazol-3-ylsulfanyl)-propylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL118178 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002992 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002992&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10394618 103917033 CHEMBL118178 C03800 ZINC27105876 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004818 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ncc(CO)n1C InChI=1S/C35H54N6O6S2/c1-40-27(22-42)21-37-34(40)49-18-15-30(43)28(19-24-9-5-3-6-10-24)38-32(44)29(23-48-2)39-33(45)31(20-25-11-7-4-8-12-25)47-35(46)41-16-13-26(36)14-17-41/h4,7-8,11-12,21,24,26,28-31,42-43H,3,5-6,9-10,13-20,22-23,36H2,1-2H3,(H,38,44)(H,39,45)/t28-,29-,30-,31-/m0/s1 UICFCOFDSWADFQ-ORYMTKCHSA-N 50002969 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(1-methyl-1H-tetrazol-5-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL334254 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002969&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10439855 103917010 CHEMBL334254 C03800 ZINC27105854 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004821 CSCCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C36H53N5O5S2/c1-47-22-17-29(39-35(44)32(25-27-12-6-3-7-13-27)46-36(45)41-20-15-28(37)16-21-41)34(43)40-30(24-26-10-4-2-5-11-26)31(42)18-23-48-33-14-8-9-19-38-33/h3,6-9,12-14,19,26,28-32,42H,2,4-5,10-11,15-18,20-25,37H2,1H3,(H,39,44)(H,40,43)/t29?,30-,31-,32-/m0/s1 PMSOAMPMDRCKQW-PTMYVKAOSA-N 50002986 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-3-methylsulfanyl-propylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL325822 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002986 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002986&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44345111 103917027 CHEMBL325822 ZINC27107355 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004827 CCCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C36H53N5O5S/c1-2-11-29(39-35(44)32(25-27-14-7-4-8-15-27)46-36(45)41-21-17-28(37)18-22-41)34(43)40-30(24-26-12-5-3-6-13-26)31(42)19-23-47-33-16-9-10-20-38-33/h4,7-10,14-16,20,26,28-32,42H,2-3,5-6,11-13,17-19,21-25,37H2,1H3,(H,39,44)(H,40,43)/t29?,30-,31-,32-/m0/s1 LVGMKZGFMFKDTM-PTMYVKAOSA-N 50002975 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-butylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL325721 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002975&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44345017 103917016 CHEMBL325721 ZINC27106900 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004828 CSCC(NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C35H51N5O5S2/c1-46-24-29(39-34(43)31(23-26-12-6-3-7-13-26)45-35(44)40-19-15-27(36)16-20-40)33(42)38-28(22-25-10-4-2-5-11-25)30(41)17-21-47-32-14-8-9-18-37-32/h3,6-9,12-14,18,25,27-31,41H,2,4-5,10-11,15-17,19-24,36H2,1H3,(H,38,42)(H,39,43)/t28-,29?,30-,31-/m0/s1 OMQKMJJDKHVGCK-LFCSJMILSA-N 50002989 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL325241 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002989 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002989&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44345134 103917030 CHEMBL325241 ZINC27106842 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004835 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ncccn1 InChI=1S/C34H50N6O5S2/c1-46-23-28(39-32(43)30(22-25-11-6-3-7-12-25)45-34(44)40-18-13-26(35)14-19-40)31(42)38-27(21-24-9-4-2-5-10-24)29(41)15-20-47-33-36-16-8-17-37-33/h3,6-8,11-12,16-17,24,26-30,41H,2,4-5,9-10,13-15,18-23,35H2,1H3,(H,38,42)(H,39,43)/t27-,28-,29-,30-/m0/s1 LWOMUKMVKQHDJB-KRCBVYEFSA-N 50002987 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-4-(pyrimidin-2-ylsulfanyl)-butylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL116247 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002987 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002987&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10101137 103917028 CHEMBL116247 C03800 ZINC27102210 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004839 NC1CCN(CC1)C(=O)O[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C37H51N7O5S/c38-28-14-18-44(19-15-28)37(48)49-33(22-27-11-5-2-6-12-27)36(47)43-31(23-29-24-39-25-41-29)35(46)42-30(21-26-9-3-1-4-10-26)32(45)16-20-50-34-13-7-8-17-40-34/h2,5-8,11-13,17,24-26,28,30-33,45H,1,3-4,9-10,14-16,18-23,38H2,(H,39,41)(H,42,46)(H,43,47)/t30-,31-,32-,33-/m0/s1 OZFZEVAJUHXLRM-YRCZKMHPSA-N 50002974 4-Amino-piperidine-1-carboxylic acid 1-[1-[1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-2-(1H-imidazol-4-yl)-ethylcarbamoyl]-2-phenyl-ethyl ester::CHEMBL118421 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002974&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10078474 103917015 CHEMBL118421 ZINC27107104 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50004840 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)OC(=O)N1CCC(N)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)COc1ccccn1 InChI=1S/C34H49N5O6S/c1-46-23-28(32(41)37-27(20-24-10-4-2-5-11-24)29(40)22-44-31-14-8-9-17-36-31)38-33(42)30(21-25-12-6-3-7-13-25)45-34(43)39-18-15-26(35)16-19-39/h3,6-9,12-14,17,24,26-30,40H,2,4-5,10-11,15-16,18-23,35H2,1H3,(H,37,41)(H,38,42)/t27-,28-,29-,30-/m0/s1 GLGHTVSPWJNXLJ-KRCBVYEFSA-N 50002990 4-Amino-piperidine-1-carboxylic acid 1-{1-[1-cyclohexylmethyl-2-hydroxy-3-(pyridin-2-yloxy)-propylcarbamoyl]-2-methylsulfanyl-ethylcarbamoyl}-2-phenyl-ethyl ester::CHEMBL324384 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00097a010 10.7270/Q2DB80S4 1404233 Raddatz, P; Jonczyk, A; Minck, KO; Rippmann, F; Schittenhelm, C; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002990 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002990&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10416894 103917031 CHEMBL324384 C03800 ZINC27101856 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007719 CCSC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C31H52N4O7S2/c1-4-43-31(30(39)32-25(20-23-11-7-5-8-12-23)28(37)27(36)19-22(2)3)33-29(38)26(21-24-13-9-6-10-14-24)34-44(40,41)35-15-17-42-18-16-35/h6,9-10,13-14,22-23,25-28,31,34,36-37H,4-5,7-8,11-12,15-21H2,1-3H3,(H,32,39)(H,33,38)/t25-,26-,27-,28+,31?/m0/s1 KJPRBAWNGKPDKH-YYSMLTSASA-N 50005417 CHEMBL266334::N-[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethylsulfanyl-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 10 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005417 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005417&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659169 103918908 CHEMBL266334 ZINC25989196 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007721 CCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)NCCN1CCOCC1 InChI=1S/C34H56N6O9S/c1-2-49-34(37-32(43)29(24-27-11-7-4-8-12-27)38-50(45,46)40-17-21-48-22-18-40)33(44)36-28(23-26-9-5-3-6-10-26)30(41)25-31(42)35-13-14-39-15-19-47-20-16-39/h4,7-8,11-12,26,28-30,34,38,41H,2-3,5-6,9-10,13-25H2,1H3,(H,35,42)(H,36,44)(H,37,43)/t28-,29-,30-,34?/m0/s1 GQHIAZWMQBLQHM-LMDNDRLDSA-N 50005418 5-Cyclohexyl-4-{2-ethoxy-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-acetylamino}-3-hydroxy-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL267042 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005418 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005418&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659183 103918909 CHEMBL267042 ZINC25993747 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007725 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC#C InChI=1S/C32H50N4O8S/c1-4-17-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-18-43-19-16-36/h1,6,9-10,13-14,23-24,26-29,32,35,37-38H,5,7-8,11-12,15-22H2,2-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1 BQQOAUJVYWQLRX-GDZMZIAQSA-N 50005423 CHEMBL266139::N-[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-prop-2-ynyloxy-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 80 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005423&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659173 103918914 CHEMBL266139 ZINC25989656 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007738 CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H54F2N6O9S/c1-2-19-52-33(40-31(45)29(25-27-11-7-4-8-12-27)41-53(48,49)43-17-22-51-23-18-43)32(46)39-28(24-26-9-5-3-6-10-26)30(44)35(36,37)34(47)38-13-14-42-15-20-50-21-16-42/h4,7-8,11-12,26,28-29,33,41H,2-3,5-6,9-10,13-25H2,1H3,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,33?/m0/s1 QUSCBNSWNRTFJQ-QXSWOPKKSA-N 50005433 5-Cyclohexyl-2,2-difluoro-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-2-propoxy-acetylamino}-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL267955 Cathepsin D Bos taurus 131 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005433&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659188 103918924 CHEMBL267955 ZINC95608055 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007742 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C InChI=1S/C32H52N4O7S2/c1-4-19-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-17-43-18-16-36/h4,6,9-10,13-14,23-24,26-29,32,35,37-38H,1,5,7-8,11-12,15-22H2,2-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1 ZPQDRLPJUKSWIJ-GDZMZIAQSA-N 50005437 CHEMBL8477::N-[Allylsulfanyl-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 19 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005437&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659176 103918928 CHEMBL8477 ZINC25989100 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007743 CCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C31H52N4O8S/c1-4-43-31(30(39)32-25(20-23-11-7-5-8-12-23)28(37)27(36)19-22(2)3)33-29(38)26(21-24-13-9-6-10-14-24)34-44(40,41)35-15-17-42-18-16-35/h6,9-10,13-14,22-23,25-28,31,34,36-37H,4-5,7-8,11-12,15-21H2,1-3H3,(H,32,39)(H,33,38)/t25-,26-,27-,28+,31?/m0/s1 GQUBJSPCTRAWQA-YYSMLTSASA-N 50005428 CHEMBL8836::N-[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethoxy-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 14 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005428 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005428&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659167 103918919 CHEMBL8836 ZINC14236475 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007745 CCSC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C32H53N3O6S/c1-7-42-30(29(39)33-24(19-22-14-10-8-11-15-22)27(37)26(36)18-21(2)3)35-28(38)25(20-23-16-12-9-13-17-23)34-31(40)41-32(4,5)6/h9,12-13,16-17,21-22,24-27,30,36-37H,7-8,10-11,14-15,18-20H2,1-6H3,(H,33,39)(H,34,40)(H,35,38)/t24-,25-,26-,27+,30?/m0/s1 XQLQNLOPRYSJBA-JXSHCWFBSA-N 50005439 (1-{[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethylsulfanyl-methyl]-carbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL245193 Cathepsin D Bos taurus 28 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005439&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659181 103918930 CHEMBL245193 ZINC25989322 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007748 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC(F)(F)F InChI=1S/C31H49F3N4O8S/c1-21(2)17-26(39)27(40)24(18-22-9-5-3-6-10-22)35-29(42)30(46-20-31(32,33)34)36-28(41)25(19-23-11-7-4-8-12-23)37-47(43,44)38-13-15-45-16-14-38/h4,7-8,11-12,21-22,24-27,30,37,39-40H,3,5-6,9-10,13-20H2,1-2H3,(H,35,42)(H,36,41)/t24-,25-,26-,27+,30?/m0/s1 OLVKUCXGMNZXGZ-JXSHCWFBSA-N 50005443 CHEMBL441325::N-[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-(2,2,2-trifluoro-ethoxy)-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 21 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005443&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659174 103918934 CHEMBL441325 ZINC25989377 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007751 O[C@@H](CC(=O)NCCN1CCOCC1)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)SCC=C InChI=1S/C35H56N6O8S2/c1-2-23-50-35(38-33(44)30(25-28-11-7-4-8-12-28)39-51(46,47)41-17-21-49-22-18-41)34(45)37-29(24-27-9-5-3-6-10-27)31(42)26-32(43)36-13-14-40-15-19-48-20-16-40/h2,4,7-8,11-12,27,29-31,35,39,42H,1,3,5-6,9-10,13-26H2,(H,36,43)(H,37,45)(H,38,44)/t29-,30-,31-,35?/m0/s1 DORMUSOHCBZVOD-CNUSUHBYSA-N 50005436 4-{2-Allylsulfanyl-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-acetylamino}-5-cyclohexyl-3-hydroxy-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL8896 Cathepsin D Bos taurus 10 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005436&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659186 103918927 CHEMBL8896 ZINC25990343 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007755 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)OCC=C InChI=1S/C32H52N4O8S/c1-4-17-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-18-43-19-16-36/h4,6,9-10,13-14,23-24,26-29,32,35,37-38H,1,5,7-8,11-12,15-22H2,2-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1 GECFWRLWUREZAB-GDZMZIAQSA-N 50005442 CHEMBL262712::N-[Allyloxy-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 11 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005442&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659172 103918933 CHEMBL262712 ZINC25993586 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007758 CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H56F2N6O9S/c1-2-19-52-33(40-31(45)29(25-27-11-7-4-8-12-27)41-53(48,49)43-17-22-51-23-18-43)32(46)39-28(24-26-9-5-3-6-10-26)30(44)35(36,37)34(47)38-13-14-42-15-20-50-21-16-42/h4,7-8,11-12,26,28-30,33,41,44H,2-3,5-6,9-10,13-25H2,1H3,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30+,33?/m0/s1 DWJLWZMNUKFHOF-IKFRDQNWSA-N 50005422 5-Cyclohexyl-2,2-difluoro-3-hydroxy-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-2-propoxy-acetylamino}-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL276553 Cathepsin D Bos taurus 699 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005422&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659185 103918913 CHEMBL276553 ZINC95608318 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007762 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C33H52N6O7S/c1-23(2)17-30(40)31(41)27(18-24-9-5-3-6-10-24)36-32(42)28(20-26-21-34-22-35-26)37-33(43)29(19-25-11-7-4-8-12-25)38-47(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-24,27-31,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H,34,35)(H,36,42)(H,37,43)/t27-,28?,29-,30-,31+/m0/s1 ZJDRDAKKIABCDV-JZYZJWFTSA-N 50005445 CHEMBL267277::N-[1-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-(1H-imidazol-4-yl)-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005445&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44265653 103918936 CHEMBL267277 ZINC25990903 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007765 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)Sc1cccs1 InChI=1S/C33H50N4O7S3/c1-23(2)20-28(38)30(39)26(21-24-10-5-3-6-11-24)34-32(41)33(46-29-14-9-19-45-29)35-31(40)27(22-25-12-7-4-8-13-25)36-47(42,43)37-15-17-44-18-16-37/h4,7-9,12-14,19,23-24,26-28,30,33,36,38-39H,3,5-6,10-11,15-18,20-22H2,1-2H3,(H,34,41)(H,35,40)/t26-,27-,28-,30+,33?/m0/s1 KWLQLHIFFCXIEX-JRTRUGKUSA-N 50005444 CHEMBL406692::N-[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-(thiophen-2-ylsulfanyl)-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 470 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005444&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659178 103918935 CHEMBL406692 ZINC25991763 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007766 CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C32H54N4O8S/c1-4-17-44-32(31(40)33-26(21-24-11-7-5-8-12-24)29(38)28(37)20-23(2)3)34-30(39)27(22-25-13-9-6-10-14-25)35-45(41,42)36-15-18-43-19-16-36/h6,9-10,13-14,23-24,26-29,32,35,37-38H,4-5,7-8,11-12,15-22H2,1-3H3,(H,33,40)(H,34,39)/t26-,27-,28-,29+,32?/m0/s1 QYPDSNCYTUHFDC-GDZMZIAQSA-N 50005431 CHEMBL8665::N-[(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-propoxy-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 22 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005431&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659170 103918922 CHEMBL8665 ZINC25989258 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007770 O[C@@H](CC(=O)NCCN1CCOCC1)[C@H](CC1CCCCC1)NC(=O)C(Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C36H56N8O8S/c45-33(24-34(46)38-11-12-43-13-17-51-18-14-43)30(21-27-7-3-1-4-8-27)40-35(47)31(23-29-25-37-26-39-29)41-36(48)32(22-28-9-5-2-6-10-28)42-53(49,50)44-15-19-52-20-16-44/h2,5-6,9-10,25-27,30-33,42,45H,1,3-4,7-8,11-24H2,(H,37,39)(H,38,46)(H,40,47)(H,41,48)/t30-,31?,32-,33-/m0/s1 WDEUXEWUKXQQMN-NROWOOLRSA-N 50005420 5-Cyclohexyl-3-hydroxy-4-{3-(1H-imidazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL276372 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005420&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44265557 103918911 CHEMBL276372 ZINC95608230 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50007771 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)N(C)CC=C InChI=1S/C34H56N4O6/c1-8-19-38(7)30(32(42)35-26(21-24-15-11-9-12-16-24)29(40)28(39)20-23(2)3)37-31(41)27(22-25-17-13-10-14-18-25)36-33(43)44-34(4,5)6/h8,10,13-14,17-18,23-24,26-30,39-40H,1,9,11-12,15-16,19-22H2,2-7H3,(H,35,42)(H,36,43)(H,37,41)/t26-,27-,28-,29+,30?/m0/s1 QDRODJQHFZKMRP-HFXSEVENSA-N 50005425 (1-{[(Allyl-methyl-amino)-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-methyl]-carbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL418519 Cathepsin D Bos taurus 60 ChEMBL 10.1021/jm00084a008 10.7270/Q2NG4PKR 1552498 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005425 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005425&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659182 103918916 CHEMBL418519 ZINC25994847 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014780 CCC(C)CNC(=O)C[C@H](O)C(CC(C)C)NC(=O)C(CC#CCNC(=O)OCc1ccccc1)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12 InChI=1S/C51H60N4O6/c1-5-36(4)33-53-48(57)32-47(56)46(29-35(2)3)55-50(59)45(27-13-14-28-52-51(60)61-34-37-17-7-6-8-18-37)54-49(58)42(30-40-23-15-21-38-19-9-11-25-43(38)40)31-41-24-16-22-39-20-10-12-26-44(39)41/h6-12,15-26,35-36,42,45-47,56H,5,27-34H2,1-4H3,(H,52,60)(H,53,57)(H,54,58)(H,55,59)/t36?,45?,46?,47-/m0/s1 DEKASTZDMCFHIL-NDTXXLJKSA-N 50009882 CHEMBL22888::[5-{1-[1-Hydroxy-2-(2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-5-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-pent-2-ynyl]-carbamic acid benzyl ester Cathepsin D Bos taurus 1922 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009882 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009882&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458530 103922864 CHEMBL22888 ZINC95541779 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014799 CCC(C)CNC(=O)C[C@H](O)C(CC(C)C)NC(=O)C(CC#CCNC(C)=O)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12 InChI=1S/C45H56N4O5/c1-6-31(4)29-47-43(52)28-42(51)41(25-30(2)3)49-45(54)40(23-11-12-24-46-32(5)50)48-44(53)37(26-35-19-13-17-33-15-7-9-21-38(33)35)27-36-20-14-18-34-16-8-10-22-39(34)36/h7-10,13-22,30-31,37,40-42,51H,6,23-29H2,1-5H3,(H,46,50)(H,47,52)(H,48,53)(H,49,54)/t31?,40?,41?,42-/m0/s1 FYFNTNIHCKLXIV-VDDYOABDSA-N 50009879 4-[6-Acetylamino-2-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-hex-4-ynoylamino]-3-hydroxy-6-methyl-heptanoic acid (2-methyl-butyl)-amide::CHEMBL23793 Cathepsin D Bos taurus 78 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009879 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009879&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458536 103922861 CHEMBL23793 ZINC28258339 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014815 CCC(C)CNC(=O)C[C@H](O)C(CC(C)C)NC(=O)C(CCCCNC(=S)NC)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12 InChI=1S/C45H61N5O4S/c1-6-31(4)29-48-42(52)28-41(51)40(25-30(2)3)50-44(54)39(23-11-12-24-47-45(55)46-5)49-43(53)36(26-34-19-13-17-32-15-7-9-21-37(32)34)27-35-20-14-18-33-16-8-10-22-38(33)35/h7-10,13-22,30-31,36,39-41,51H,6,11-12,23-29H2,1-5H3,(H,48,52)(H,49,53)(H,50,54)(H2,46,47,55)/t31?,39?,40?,41-/m0/s1 FSGCSGPTSJSHHI-PASJKQFYSA-N 50009905 3-Hydroxy-6-methyl-4-[6-(3-methyl-thioureido)-2-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-hexanoylamino]-heptanoic acid (2-methyl-butyl)-amide::CHEMBL23232 Cathepsin D Bos taurus 781 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009905 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009905&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458783 103922887 CHEMBL23232 ZINC95607170 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014819 CC(C)(C)OC(=O)NCC#CCC(NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12)C(=O)NC(CC1CCCCC1)[C@@H](O)CC(=O)N1CCOC(CCN)C1 InChI=1S/C52H67N5O7/c1-52(2,3)64-51(62)54-28-12-11-25-45(50(61)56-46(31-36-15-5-4-6-16-36)47(58)34-48(59)57-29-30-63-42(35-57)26-27-53)55-49(60)41(32-39-21-13-19-37-17-7-9-23-43(37)39)33-40-22-14-20-38-18-8-10-24-44(38)40/h7-10,13-14,17-24,36,41-42,45-47,58H,4-6,15-16,25-35,53H2,1-3H3,(H,54,62)(H,55,60)(H,56,61)/t42?,45?,46?,47-/m0/s1 QJGASVJTWTYJAK-LYOGXYCBSA-N 50009913 CHEMBL22678::[5-{4-[2-(2-Amino-ethyl)-morpholin-4-yl]-1-cyclohexylmethyl-2-hydroxy-4-oxo-butylcarbamoyl}-5-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-pent-2-ynyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 81000 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009913&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458677 103922895 CHEMBL22678 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014825 CNC(=S)NCCCCC(NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12)C(=O)NC(CC(C)C)[C@@H](O)CC(=O)N1CCOC(CCN)C1 InChI=1S/C46H62N6O5S/c1-31(2)26-41(42(53)29-43(54)52-24-25-57-37(30-52)21-22-47)51-45(56)40(20-8-9-23-49-46(58)48-3)50-44(55)36(27-34-16-10-14-32-12-4-6-18-38(32)34)28-35-17-11-15-33-13-5-7-19-39(33)35/h4-7,10-19,31,36-37,40-42,53H,8-9,20-30,47H2,1-3H3,(H,50,55)(H,51,56)(H2,48,49,58)/t37?,40?,41?,42-/m0/s1 QJWWZBWMLPVXMI-WHIWUVKUSA-N 50009901 6-(3-Methyl-thioureido)-2-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-hexanoic acid {4-[2-(2-amino-ethyl)-morpholin-4-yl]-2-hydroxy-1-isobutyl-4-oxo-butyl}-amide::CHEMBL281134 Cathepsin D Bos taurus 5403 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009901 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009901&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458685 103922883 CHEMBL281134 ZINC95542447 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014827 CCC(C)CNC(=O)C[C@H](O)C(CC(C)C)NC(=O)C(CCCCCNC(=N)N[N+]([O-])=O)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12 InChI=1S/C45H61N7O6/c1-5-31(4)29-48-42(54)28-41(53)40(25-30(2)3)50-44(56)39(23-7-6-12-24-47-45(46)51-52(57)58)49-43(55)36(26-34-19-13-17-32-15-8-10-21-37(32)34)27-35-20-14-18-33-16-9-11-22-38(33)35/h8-11,13-22,30-31,36,39-41,53H,5-7,12,23-29H2,1-4H3,(H,48,54)(H,49,55)(H,50,56)(H3,46,47,51)/t31?,39?,40?,41-/m0/s1 KOYYNTVXZJGAPD-PASJKQFYSA-N 50009887 1N-(2-methylbutyl)-4-{6-amino(nitro)(imino)methylamino-1-[2-(1-naphthyl)-1-(1-naphthylmethyl)ethylcarboxamido]hexylcarboxamido}-3-hydroxy-6-methyl-(3S,4R)-heptanamide::CHEMBL23792 Cathepsin D Bos taurus 1471 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009887 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009887&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458679 103922869 CHEMBL23792 ZINC95607243 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014831 CNC(=S)NCCCCC(NC(=O)C(Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)NC(CC1CCCCC1)[C@@H](O)CC(=O)N1CCOC(CCN)C1 InChI=1S/C38H64N8O8S2/c1-40-38(55)41-17-9-8-14-31(42-37(50)33(25-29-12-6-3-7-13-29)44-56(51,52)46-19-21-53-22-20-46)36(49)43-32(24-28-10-4-2-5-11-28)34(47)26-35(48)45-18-23-54-30(27-45)15-16-39/h3,6-7,12-13,28,30-34,44,47H,2,4-5,8-11,14-27,39H2,1H3,(H,42,50)(H,43,49)(H2,40,41,55)/t30?,31?,32?,33?,34-/m0/s1 JXJSFUYIFVZHMV-XMCIUJAFSA-N 50009918 6-(3-Methyl-thioureido)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-hexanoic acid {4-[2-(2-amino-ethyl)-morpholin-4-yl]-1-cyclohexylmethyl-2-hydroxy-4-oxo-butyl}-amide::CHEMBL23199 Cathepsin D Bos taurus 33150.0 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009918&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458699 103922900 CHEMBL23199 ZINC95607204 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50014832 CCC(C)CNC(=O)C[C@H](O)C(CC1CCCCC1)NC(=O)C(CCCCNC(=S)NC)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12 InChI=1S/C48H65N5O4S/c1-4-33(2)32-51-45(55)31-44(54)43(28-34-16-6-5-7-17-34)53-47(57)42(26-12-13-27-50-48(58)49-3)52-46(56)39(29-37-22-14-20-35-18-8-10-24-40(35)37)30-38-23-15-21-36-19-9-11-25-41(36)38/h8-11,14-15,18-25,33-34,39,42-44,54H,4-7,12-13,16-17,26-32H2,1-3H3,(H,51,55)(H,52,56)(H,53,57)(H2,49,50,58)/t33?,42?,43?,44-/m0/s1 ZAZTWBIXYDMKTI-FMBQCHBFSA-N 50009917 6-(3-Methyl-thioureido)-2-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-hexanoic acid [1-cyclohexylmethyl-2-hydroxy-3-(2-methyl-butylcarbamoyl)-propyl]-amide::CHEMBL22505 Cathepsin D Bos taurus 3200 ChEMBL 10.1021/jm00108a004 10.7270/Q21C1VT6 1901910 Doherty, AM; Kaltenbronn, JS; Hudspeth, JP; Repine, JT; Roark, WH; Sircar, I; Tinney, FJ; Connolly, CJ; Hodges, JC; Taylor, MD Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50009917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50009917&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44458760 103922899 CHEMBL22505 ZINC95607114 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50030056 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C InChI=1S/C29H48N4O5/c1-18(2)13-14-30-28(37)21(7)31-26(36)17-24(34)23(16-22-11-9-8-10-12-22)32-29(38)27(20(5)6)33-25(35)15-19(3)4/h8-12,18-21,23-24,27,34H,13-17H2,1-7H3,(H,30,37)(H,31,36)(H,32,38)(H,33,35)/t21-,23-,24-,27+/m0/s1 WCSGYAARMZFPGM-HZMCFHPPSA-N 50452260 CHEMBL3084308 Cathepsin D Bos taurus 1070 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50452260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50452260&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 76331516 225145627 CHEMBL3084308 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50030059 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C InChI=1S/C29H48N4O6/c1-18(2)14-15-30-26(36)20(5)31-24(35)17-23(34)22(16-21-12-10-9-11-13-21)32-27(37)25(19(3)4)33-28(38)39-29(6,7)8/h9-13,18-20,22-23,25,34H,14-17H2,1-8H3,(H,30,36)(H,31,35)(H,32,37)(H,33,38)/t20?,22?,23-,25+/m0/s1 KAVIURCQYOJSCT-QAJHKDKJSA-N 50025529 (1-{1-Benzyl-2-hydroxy-3-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-propylcarbamoyl}-2-methyl-propyl)-carbamic acid tert-butyl ester::CHEMBL3392087 Cathepsin D Bos taurus 370 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025529&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725163 103935403 CHEMBL3392087CHEMBL311234 ZINC26505067 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50030060 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C32H61N5O6/c1-18(2)14-15-33-28(39)23(10)34-25(38)17-22(9)24(16-19(3)4)35-29(40)26(20(5)6)36-30(41)27(21(7)8)37-31(42)43-32(11,12)13/h18-24,26-27H,14-17H2,1-13H3,(H,33,39)(H,34,38)(H,35,40)(H,36,41)(H,37,42)/t22-,23?,24?,26?,27+/m0/s1 XHAGYXYLFCHAMX-AEHWDRQNSA-N 50025512 CHEMBL3392094::{2-Methyl-1-[2-methyl-1-(3-methyl-1-{1-methyl-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-butylcarbamoyl)-propylcarbamoyl]-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 2000 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025512&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725170 103935386 CHEMBL3392094CHEMBL84744 ZINC36295225 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50030017 CC[C@H](C)[C@H](NC(=O)C(F)(F)C(=O)C(CC(C)C)NC(=O)[C@H](CC1N=CC=N1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 InChI=1S/C43H58F2N8O7/c1-6-27(2)35(39(57)49-26-30-19-13-14-20-46-30)53-40(58)43(44,45)36(54)31(23-28-15-9-7-10-16-28)50-38(56)33(25-34-47-21-22-48-34)51-37(55)32(24-29-17-11-8-12-18-29)52-41(59)60-42(3,4)5/h8,11-14,17-22,27-28,31-35H,6-7,9-10,15-16,23-26H2,1-5H3,(H,49,57)(H,50,56)(H,51,55)(H,52,59)(H,53,58) JWZGXCLUMDSLEP-UHFFFAOYSA-N 50024145 CHEMBL3350345::{1-[1-(1-Cyclohexylmethyl-3,3-difluoro-3-{2-methyl-1-[(pyridin-2-ylmethyl)-carbamoyl]-butylcarbamoyl}-2-oxo-propylcarbamoyl)-2-(2H-imidazol-2-yl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 1700 ChEMBL 10.1021/jm00160a048 10.7270/Q25X29G7 3531517 Thaisrivongs, S; Pals, DT; Kati, WM; Turner, SR; Thomasco, LM; Watt, W TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50024145 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50024145&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118718849 103934436 CHEMBL3350345CHEMBL63687 ZINC95537905 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034560 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H]1COCCCCCCCN([C@H](C)C(=O)N1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC InChI=1S/C45H70N8O10/c1-10-29(4)37(41(57)48-34(43(59)61-9)24-32-25-46-27-47-32)52-40(56)36(28(2)3)51-39(55)35-26-62-22-18-13-11-12-17-21-53(30(5)38(54)49-35)42(58)33(23-31-19-15-14-16-20-31)50-44(60)63-45(6,7)8/h14-16,19-20,25,27-30,33-37H,10-13,17-18,21-24,26H2,1-9H3,(H,46,47)(H,48,57)(H,49,54)(H,50,60)(H,51,55)(H,52,56)/t29-,30+,33-,34-,35+,36-,37-/m0/s1 GKKULMDDWMBPTR-CDWRKOINSA-N 50022863 2-[2-(2-{[7-(2-tert-Butoxycarbonylamino-3-phenyl-propionyl)-6-methyl-5-oxo-1-oxa-4,7-diaza-cyclotetradecane-3-carbonyl]-amino}-3-methyl-butyrylamino)-3-methyl-pentanoylamino]-3-(3H-imidazol-4-yl)-propionic acid methyl ester::CHEMBL433013 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022863 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022863&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331167 103933416 CHEMBL433013 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034563 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC InChI=1S/C42H66N8O9/c1-13-26(6)34(38(54)46-32(40(56)58-12)21-29-22-43-23-44-29)49-37(53)33(25(4)5)48-36(52)30(19-24(2)3)45-35(51)27(7)50(11)39(55)31(20-28-17-15-14-16-18-28)47-41(57)59-42(8,9)10/h14-18,22-27,30-34H,13,19-21H2,1-12H3,(H,43,44)(H,45,51)(H,46,54)(H,47,57)(H,48,52)(H,49,53)/t26-,27-,30-,31-,32-,33-,34-/m0/s1 GAENVHATERNULE-ZEEPROBFSA-N 50022864 Boc-Phe-(CH3)Ala-Leu-Val-Ile-His-OMe::CHEMBL318242 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022864 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022864&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331134 103933417 CHEMBL318242 ZINC95610583 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034568 CCC(C)(N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NC(CC(C)C)C(O)CC(=O)N[C@@H](C)C(=O)NC(CC(C)C)C(O)CC(O)=O InChI=1S/C34H64N6O9/c1-12-34(11,35)33(49)40-29(20(8)9)32(48)39-28(19(6)7)31(47)38-22(13-17(2)3)24(41)15-26(43)36-21(10)30(46)37-23(14-18(4)5)25(42)16-27(44)45/h17-25,28-29,41-42H,12-16,35H2,1-11H3,(H,36,43)(H,37,46)(H,38,47)(H,39,48)(H,40,49)(H,44,45)/t21-,22?,23?,24?,25?,28-,29-,34?/m0/s1 OQUMTPGNPJBXDI-SKVWWOFPSA-N 50022866 4-[1-{3-[1-[1-(1-amino-1-methylpropylcarboxamido)-2-methyl-(1S)-propylcarboxamido]-2-methyl-(1S)-propylcarboxamido]-2-hydroxy-5-methylhexylcarboxamido}-(1S)-ethylcarboxamido]-3-hydroxy-6-methylheptanoic acid::CHEMBL98582 Cathepsin D Bos taurus 46 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022866 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022866&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331168 103933419 CHEMBL98582 C03834 ZINC37108081 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034569 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC InChI=1S/C44H66N10O9/c1-11-27(6)36(41(59)51-34(42(60)62-10)20-30-22-46-24-48-30)54-40(58)35(26(4)5)53-39(57)31(17-25(2)3)49-38(56)33(19-29-21-45-23-47-29)50-37(55)32(18-28-15-13-12-14-16-28)52-43(61)63-44(7,8)9/h12-16,21-27,31-36H,11,17-20H2,1-10H3,(H,45,47)(H,46,48)(H,49,56)(H,50,55)(H,51,59)(H,52,61)(H,53,57)(H,54,58)/t27-,31-,32-,33-,34-,35-,36-/m0/s1 DACRXUMALCQYAS-JHNSYDJNSA-N 50022865 Boc-Phe-His-Leu-Val-Ile-His-OMe::CHEMBL321937 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022865 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022865&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331132 103933418 CHEMBL321937 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034580 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H]1COCCCCCN([C@H](C)C(=O)N1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC InChI=1S/C43H66N8O10/c1-10-27(4)35(39(55)46-32(41(57)59-9)22-30-23-44-25-45-30)50-38(54)34(26(2)3)49-37(53)33-24-60-20-16-12-15-19-51(28(5)36(52)47-33)40(56)31(21-29-17-13-11-14-18-29)48-42(58)61-43(6,7)8/h11,13-14,17-18,23,25-28,31-35H,10,12,15-16,19-22,24H2,1-9H3,(H,44,45)(H,46,55)(H,47,52)(H,48,58)(H,49,53)(H,50,54)/t27-,28+,31-,32-,33+,34-,35-/m0/s1 UWJDXBLBDXDXEK-OUXIQBBVSA-N 50022867 2-[2-(2-{[7-(2-tert-Butoxycarbonylamino-3-phenyl-propionyl)-6-methyl-5-oxo-1-oxa-4,7-diaza-cyclododecane-3-carbonyl]-amino}-3-methyl-butyrylamino)-3-methyl-pentanoylamino]-3-(3H-imidazol-4-yl)-propionic acid methyl ester::CHEMBL97865 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022867 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022867&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331191 103933420 CHEMBL97865 ZINC95545789 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034581 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H]1COCCCN([C@H](C)C(=O)N1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC InChI=1S/C41H62N8O10/c1-10-25(4)33(37(53)44-30(39(55)57-9)20-28-21-42-23-43-28)48-36(52)32(24(2)3)47-35(51)31-22-58-18-14-17-49(26(5)34(50)45-31)38(54)29(19-27-15-12-11-13-16-27)46-40(56)59-41(6,7)8/h11-13,15-16,21,23-26,29-33H,10,14,17-20,22H2,1-9H3,(H,42,43)(H,44,53)(H,45,50)(H,46,56)(H,47,51)(H,48,52)/t25-,26+,29-,30-,31+,32-,33-/m0/s1 GTUGRJBQGCGAQL-OOAKFPIBSA-N 50022868 2-[2-(2-{[7-(2-tert-Butoxycarbonylamino-3-phenyl-propionyl)-6-methyl-5-oxo-[1,4,7]oxadiazecane-3-carbonyl]-amino}-3-methyl-butyrylamino)-3-methyl-pentanoylamino]-3-(3H-imidazol-4-yl)-propionic acid methyl ester::CHEMBL445118 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022868 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022868&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331135 103933421 CHEMBL445118 ZINC95614942 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034584 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)OC InChI=1S/C41H64N8O9/c1-12-25(6)33(38(54)46-31(39(55)57-11)20-28-21-42-22-43-28)49-37(53)32(24(4)5)48-36(52)29(18-23(2)3)45-34(50)26(7)44-35(51)30(19-27-16-14-13-15-17-27)47-40(56)58-41(8,9)10/h13-17,21-26,29-33H,12,18-20H2,1-11H3,(H,42,43)(H,44,51)(H,45,50)(H,46,54)(H,47,56)(H,48,52)(H,49,53)/t25-,26-,29-,30-,31-,32-,33-/m0/s1 HSIRWURLJCQVII-MRHHCFRNSA-N 50022862 Boc-Phe-Ala-Leu-Val-Ile-His-OMe::CHEMBL101874 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00397a003 10.7270/Q2S75FBX 3276890 Sham, HL; Bolis, G; Stein, HH; Fesik, SW; Marcotte, PA; Plattner, JJ; Rempel, CA; Greer, J Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022862 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022862&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44331133 103933415 CHEMBL101874 ZINC95541717 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034795 CC(C)S(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C37H55N3O7S/c1-26(2)48(45,46)22-21-33(41)30(23-27-15-9-6-10-16-27)38-34(42)31(24-28-17-11-7-12-18-28)39-35(43)32(25-29-19-13-8-14-20-29)40-36(44)47-37(3,4)5/h7-8,11-14,17-20,26-27,30-33,41H,6,9-10,15-16,21-25H2,1-5H3,(H,38,42)(H,39,43)(H,40,44)/t30-,31-,32-,33-/m0/s1 WTRKSUULNDVNSA-YRCZKMHPSA-N 50023061 (1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-2-phenyl-ethylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL294999 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023061&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891146 103933603 CHEMBL294999 ZINC29467323 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034797 COc1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)CCS(=O)(=O)C(C)C)cc1 InChI=1S/C35H55N5O8S/c1-23(2)49(45,46)17-16-31(41)28(18-24-10-8-7-9-11-24)38-33(43)30(20-26-21-36-22-37-26)39-32(42)29(40-34(44)48-35(3,4)5)19-25-12-14-27(47-6)15-13-25/h12-15,21-24,28-31,41H,7-11,16-20H2,1-6H3,(H,36,37)(H,38,43)(H,39,42)(H,40,44)/t28-,29-,30-,31-/m0/s1 UPZQIWBZGUFDCQ-ORYMTKCHSA-N 50023059 CHEMBL45727::[1-[1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-2-(3H-imidazol-4-yl)-ethylcarbamoyl]-2-(4-methoxy-phenyl)-ethyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023059 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023059&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891132 103933601 CHEMBL45727 ZINC29415502 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034805 CC(C)S(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C31H51N3O7S/c1-21(2)42(39,40)18-17-27(35)25(19-23-13-9-7-10-14-23)33-28(36)22(3)32-29(37)26(20-24-15-11-8-12-16-24)34-30(38)41-31(4,5)6/h8,11-12,15-16,21-23,25-27,35H,7,9-10,13-14,17-20H2,1-6H3,(H,32,37)(H,33,36)(H,34,38)/t22-,25-,26-,27-/m0/s1 AUNYAGQZDOFZMA-OXCFDMGDSA-N 50023065 (1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-ethylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL299870 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023065 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023065&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891140 103933607 CHEMBL299870 ZINC29464595 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034812 CC(C)S(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C34H53N5O7S/c1-23(2)47(44,45)17-16-30(40)27(18-24-12-8-6-9-13-24)37-32(42)29(20-26-21-35-22-36-26)38-31(41)28(19-25-14-10-7-11-15-25)39-33(43)46-34(3,4)5/h7,10-11,14-15,21-24,27-30,40H,6,8-9,12-13,16-20H2,1-5H3,(H,35,36)(H,37,42)(H,38,41)(H,39,43)/t27-,28-,29-,30-/m0/s1 JKJRNMWCKRTZJU-KRCBVYEFSA-N 50023062 ((S)-1-{(S)-1-[1-Cyclohexylmethyl-2-hydroxy-4-((S)-propane-2-sulfonyl)-butylcarbamoyl]-2-(S)-1H-imidazol-4-yl-ethylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL382977::{1-[1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-2-(3H-imidazol-4-yl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023062 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023062&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891128 103933604 CHEMBL382977 ZINC28529007 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034814 CC(C)S(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)(C)C InChI=1S/C35H55N5O6S/c1-24(2)47(45,46)17-16-31(41)28(18-25-12-8-6-9-13-25)39-34(44)30(20-27-22-36-23-37-27)40-33(43)29(19-26-14-10-7-11-15-26)38-32(42)21-35(3,4)5/h7,10-11,14-15,22-25,28-31,41H,6,8-9,12-13,16-21H2,1-5H3,(H,36,37)(H,38,42)(H,39,44)(H,40,43)/t28-,29-,30-,31-/m0/s1 BJWWMAAXHWDCAX-ORYMTKCHSA-N 50023064 CHEMBL297628::N-{1-[1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-2-(3H-imidazol-4-yl)-ethylcarbamoyl]-2-phenyl-ethyl}-3,3-dimethyl-butyramide Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023064 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023064&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891136 103933606 CHEMBL297628 ZINC29416135 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034816 CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C InChI=1S/C32H49N5O7S/c1-4-44-32(41)37-27(18-24-13-9-6-10-14-24)30(39)36-28(19-25-20-33-21-34-25)31(40)35-26(17-23-11-7-5-8-12-23)29(38)15-16-45(42,43)22(2)3/h6,9-10,13-14,20-23,26-29,38H,4-5,7-8,11-12,15-19H2,1-3H3,(H,33,34)(H,35,40)(H,36,39)(H,37,41)/t26-,27-,28-,29-/m0/s1 ANXBKJHIJWQCHH-DZUOILHNSA-N 50023057 CHEMBL300036::{1-[1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-2-(3H-imidazol-4-yl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid ethyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023057 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023057&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891138 103933599 CHEMBL300036 ZINC29465397 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034826 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C InChI=1S/C34H57N3O7S/c1-23(2)20-28(36-32(40)29(22-26-16-12-9-13-17-26)37-33(41)44-34(5,6)7)31(39)35-27(21-25-14-10-8-11-15-25)30(38)18-19-45(42,43)24(3)4/h9,12-13,16-17,23-25,27-30,38H,8,10-11,14-15,18-22H2,1-7H3,(H,35,39)(H,36,40)(H,37,41)/t27-,28-,29-,30-/m0/s1 JMAABOIQSWCINN-KRCBVYEFSA-N 50023058 (1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-sulfonyl)-butylcarbamoyl]-3-methyl-butylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL50412 Cathepsin D Bos taurus 8000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023058 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023058&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891144 103933600 CHEMBL50412 ZINC29465383 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034832 CCS(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C33H51N5O7S/c1-5-46(43,44)17-16-29(39)26(18-23-12-8-6-9-13-23)36-31(41)28(20-25-21-34-22-35-25)37-30(40)27(19-24-14-10-7-11-15-24)38-32(42)45-33(2,3)4/h7,10-11,14-15,21-23,26-29,39H,5-6,8-9,12-13,16-20H2,1-4H3,(H,34,35)(H,36,41)(H,37,40)(H,38,42)/t26-,27-,28-,29-/m0/s1 FAQKQMALCLBRHM-DZUOILHNSA-N 50023070 CHEMBL300724::{1-[1-(1-Cyclohexylmethyl-4-ethanesulfonyl-2-hydroxy-butylcarbamoyl)-2-(3H-imidazol-4-yl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023070&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891130 103933612 CHEMBL300724 ZINC29464601 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034837 CCS(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C30H49N3O7S/c1-6-41(38,39)18-17-26(34)24(19-22-13-9-7-10-14-22)32-27(35)21(2)31-28(36)25(20-23-15-11-8-12-16-23)33-29(37)40-30(3,4)5/h8,11-12,15-16,21-22,24-26,34H,6-7,9-10,13-14,17-20H2,1-5H3,(H,31,36)(H,32,35)(H,33,37)/t21-,24-,25-,26-/m0/s1 RMNGWAGLIUSESA-PZYJALBSSA-N 50023063 CHEMBL301528::{1-[1-(1-Cyclohexylmethyl-4-ethanesulfonyl-2-hydroxy-butylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00393a008 10.7270/Q2MK6BW4 3309313 Bolis, G; Fung, AK; Greer, J; Kleinert, HD; Marcotte, PA; Perun, TJ; Plattner, JJ; Stein, HH Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50023063 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50023063&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 13891142 103933605 CHEMBL301528 ZINC29464592 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033863 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26+,27?,28+/m0/s1 IEWAGORIVPFRDB-FBHWMOSWSA-N 50012246 CHEMBL58153::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus 46.0 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012246&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300955 103924540 CHEMBL58153 ZINC29565616 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033955 CC[C@H](C)[C@H](NC(=O)C(F)(F)C(=O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 InChI=1S/C40H54F2N8O7/c1-8-25(4)32(36(54)45-22-27-16-12-13-17-44-27)50-37(55)40(41,42)33(51)29(18-24(2)3)47-35(53)31(20-28-21-43-23-46-28)48-34(52)30(19-26-14-10-9-11-15-26)49-38(56)57-39(5,6)7/h9-17,21,23-25,29-32H,8,18-20,22H2,1-7H3,(H,43,46)(H,45,54)(H,47,53)(H,48,52)(H,49,56)(H,50,55)/t25-,29?,30-,31-,32-/m0/s1 YJEITIRWMUEULI-WNTFFZHHSA-N 50022510 Boc-Phe-His-Leu-CF3-Ile-Amp::CHEMBL154795 Cathepsin D Bos taurus 4 3.2 ChEMBL 10.1021/jm00398a022 10.7270/Q2B85742 3126296 Maibaum, J; Rich, DH University of Wisconsin http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022510&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44371838 103933107 CHEMBL154795 ZINC95605969 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033967 CC[C@H](C)[C@H](NC(=O)C(CC(O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(C)C)C(=O)NCc1ccccn1 InChI=1S/C50H75N9O8/c1-11-33(6)43(47(64)53-29-35-20-15-16-22-52-35)57-44(61)37(32(4)5)27-42(60)38(24-31(2)3)55-46(63)41(26-36-28-51-30-54-36)58(10)48(65)39(25-34-18-13-12-14-19-34)56-45(62)40-21-17-23-59(40)49(66)67-50(7,8)9/h12-16,18-20,22,28,30-33,37-43,60H,11,17,21,23-27,29H2,1-10H3,(H,51,54)(H,53,64)(H,55,63)(H,56,62)(H,57,61)/t33-,37?,38?,39-,40-,41-,42?,43-/m0/s1 SASWSEQJAITMKS-XSBZJUPLSA-N 50022508 Boc-Pro-Phe-NMe-His-Leu-OHCH2-Val-Ile-Amp::CHEMBL362209 Cathepsin D Bos taurus 6.3 3.2 ChEMBL 10.1021/jm00398a022 10.7270/Q2B85742 3126296 Maibaum, J; Rich, DH University of Wisconsin http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022508&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44387610 103933105 CHEMBL362209 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033968 CC[C@H](C)[C@H](NC(=O)[C@@H](NC[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(O)=O InChI=1S/C60H91N17O10/c1-7-37(6)51(58(84)74-47(26-40-29-63-33-68-40)55(81)71-44(60(86)87)17-11-12-20-61)76-57(83)50(36(4)5)66-31-42(23-35(2)3)70-53(79)46(25-39-28-62-32-67-39)72-54(80)45(24-38-15-9-8-10-16-38)73-56(82)49-19-14-22-77(49)59(85)48(27-41-30-64-34-69-41)75-52(78)43-18-13-21-65-43/h8-10,15-16,28-30,32-37,42-51,65-66H,7,11-14,17-27,31,61H2,1-6H3,(H,62,67)(H,63,68)(H,64,69)(H,70,79)(H,71,81)(H,72,80)(H,73,82)(H,74,84)(H,75,78)(H,76,83)(H,86,87)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-/m0/s1 XIZSMQBWVQNHCA-NIRMQQKASA-N 50022518 CHEMBL407670::Pro-His-Pro-Phe-His-Leu-CH2NH-Val-Ile-His-Lys-OH::U-76780E Cathepsin D Bos taurus 1.000 3.3 ChEMBL 10.1021/jm00398a022 10.7270/Q2B85742 3126296 Maibaum, J; Rich, DH University of Wisconsin http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022518&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 134897 103933115 CHEMBL407670 C00615 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033992 CC(C)CC(NC(=O)CCc1ccccc1)SCC(O)C(CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C44H64N6O6S/c1-30(2)23-40(50-39(52)22-21-31-15-9-6-10-16-31)57-28-38(51)35(24-32-17-11-7-12-18-32)47-42(54)37(26-34-27-45-29-46-34)48-41(53)36(25-33-19-13-8-14-20-33)49-43(55)56-44(3,4)5/h6,8-10,13-16,19-20,27,29-30,32,35-38,40,51H,7,11-12,17-18,21-26,28H2,1-5H3,(H,45,46)(H,47,54)(H,48,53)(H,49,55)(H,50,52)/t35?,36-,37-,38?,40?/m0/s1 OKBAITUXSBCPEF-DVVBUKOBSA-N 50022521 Boc-Phe-His-Cha-CH2-S-Leu-NHCO(CH2)2C6H5::CHEMBL347171 Cathepsin D Bos taurus >1 3.2 ChEMBL 10.1021/jm00398a022 10.7270/Q2B85742 3126296 Maibaum, J; Rich, DH University of Wisconsin http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022521&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44371769 103933118 CHEMBL347171 ZINC95612129 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50034102 CCCCNC(=O)[C@@H](CC(O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C(Cc1ccccc1)CS(=O)(=O)C(C)(C)C)C(C)C InChI=1S/C39H63N5O6S/c1-7-8-19-41-37(47)32(27(2)3)23-35(45)33(21-29-17-13-10-14-18-29)43-38(48)34(22-31-24-40-26-42-31)44-36(46)30(20-28-15-11-9-12-16-28)25-51(49,50)39(4,5)6/h9,11-12,15-16,24,26-27,29-30,32-35,45H,7-8,10,13-14,17-23,25H2,1-6H3,(H,40,42)(H,41,47)(H,43,48)(H,44,46)/t30?,32-,33-,34-,35?/m0/s1 GGKXIITZBSPCQP-ZPACJLJISA-N 50022582 CHEMBL53139::Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-sulfonyl)-propionylamino]-3-(3H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid butylamide Cathepsin D Bos taurus 3200 ChEMBL 10.1021/jm00117a027 10.7270/Q2Z03744 3137345 Buhlmayer, P; Caselli, A; Fuhrer, W; Goschke, R; Rasetti, V; Rueger, H; Stanton, JL; Criscione, L; Wood, JM Ciba-Geigy Limited http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022582&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44297462 103933169 CHEMBL53139 ZINC29487371 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50037985 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OC(=O)c1ccccc1 InChI=1S/C39H59N2O7P/c1-4-6-25-36(47-49(46,27-17-22-31-18-11-8-12-19-31)48-39(45)33-23-15-10-16-24-33)38(44)41-34(29-32-20-13-9-14-21-32)35(42)28-30(3)37(43)40-26-7-5-2/h8,10-12,15-16,18-19,23-24,30,32,34-36,42H,4-7,9,13-14,17,20-22,25-29H2,1-3H3,(H,40,43)(H,41,44)/t30-,34+,35+,36+,49?/m1/s1 DFOCXJWVMPSDCT-UWKZYUMSSA-N 50040394 (2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(less polar)::(2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(more polar)::CHEMBL146651 Cathepsin D Bos taurus 2650 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040394&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364156 103972451 CHEMBL146651 ZINC27557416 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50037990 CCC[C@@H](OP(=O)(CCCc1ccccc1)OCC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C30H52NO6P/c1-5-14-28(37-38(35,36-6-2)20-13-19-24-15-9-7-10-16-24)30(34)31-26(22-25-17-11-8-12-18-25)29(33)27(32)21-23(3)4/h7,9-10,15-16,23,25-29,32-33H,5-6,8,11-14,17-22H2,1-4H3,(H,31,34)/t26-,27-,28+,29+,38?/m0/s1 ZAFVVQFOQPAICY-SHYMYUJTSA-N 50040385 (3-Phenyl-propyl)-phosphonic acid (R)-1-((1S,2R,3S)-1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-butyl ester ethyl ester::CHEMBL356494 Cathepsin D Bos taurus 2150 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040385 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040385&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364013 103972442 CHEMBL356494 ZINC27553593 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50037993 CCC[C@@H](OP(=O)(CCCc1ccccc1)OCC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C30H52NO6P/c1-5-14-28(37-38(35,36-6-2)20-13-19-24-15-9-7-10-16-24)30(34)31-26(22-25-17-11-8-12-18-25)29(33)27(32)21-23(3)4/h7,9-10,15-16,23,25-29,32-33H,5-6,8,11-14,17-22H2,1-4H3,(H,31,34)/t26-,27-,28+,29+,38?/m0/s1 ZAFVVQFOQPAICY-SHYMYUJTSA-N 50040385 (3-Phenyl-propyl)-phosphonic acid (R)-1-((1S,2R,3S)-1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-butyl ester ethyl ester::CHEMBL356494 Cathepsin D Bos taurus 2150 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040385 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040385&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364013 103972442 CHEMBL356494 ZINC27553593 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50062560 CCOC(=O)C[C@@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H](C)CC InChI=1S/C27H51N3O7/c1-11-17(6)22(24(33)28-19(14-16(4)5)20(31)15-21(32)36-13-3)29-25(34)23(18(7)12-2)30-26(35)37-27(8,9)10/h16-20,22-23,31H,11-15H2,1-10H3,(H,28,33)(H,29,34)(H,30,35)/t17-,18-,19-,20+,22-,23-/m0/s1 MIRAMMMXFXHKPC-ACXQXYJUSA-N 50407077 CHEMBL2112264 Cathepsin D Bos taurus 4600 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407077&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71450858 163356101 CHEMBL2112264 ZINC27526411 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50063725 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CCCC)OP(=O)(CCCc1ccccc1)OCC InChI=1S/C34H59N2O6P/c1-5-8-22-32(42-43(40,41-7-3)24-16-21-28-17-12-10-13-18-28)34(39)36-30(26-29-19-14-11-15-20-29)31(37)25-27(4)33(38)35-23-9-6-2/h10,12-13,17-18,27,29-32,37H,5-9,11,14-16,19-26H2,1-4H3,(H,35,38)(H,36,39)/t27-,30+,31+,32-,43?/m1/s1 SVELIFIDZRDCNX-HXMFWDKASA-N 50040392 (3-Phenyl-propyl)-phosphonic acid (R)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl ester ethyl ester::CHEMBL436607 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040392&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10077648 103972449 CHEMBL436607 ZINC27553837 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50063726 CCC[C@@H](OP(=O)(CCCc1ccccc1)OCC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)C1CC1 InChI=1S/C29H48NO6P/c1-3-12-26(36-37(34,35-4-2)20-11-17-22-13-7-5-8-14-22)29(33)30-25(21-23-15-9-6-10-16-23)28(32)27(31)24-18-19-24/h5,7-8,13-14,23-28,31-32H,3-4,6,9-12,15-21H2,1-2H3,(H,30,33)/t25-,26+,27-,28+,37?/m0/s1 PQTNBOHYXFCJGW-GQONXMRXSA-N 50040393 (3-Phenyl-propyl)-phosphonic acid (R)-1-((1S,2R,3S)-1-cyclohexylmethyl-3-cyclopropyl-2,3-dihydroxy-propylcarbamoyl)-butyl ester ethyl ester::CHEMBL144812 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040393&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44363870 103972450 CHEMBL144812 ZINC27553146 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50063728 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OCC InChI=1S/C34H59N2O6P/c1-5-8-22-32(42-43(40,41-7-3)24-16-21-28-17-12-10-13-18-28)34(39)36-30(26-29-19-14-11-15-20-29)31(37)25-27(4)33(38)35-23-9-6-2/h10,12-13,17-18,27,29-32,37H,5-9,11,14-16,19-26H2,1-4H3,(H,35,38)(H,36,39)/t27-,30+,31+,32+,43?/m1/s1 SVELIFIDZRDCNX-WVPWFCJLSA-N 50040386 (3-Phenyl-propyl)-phosphonic acid (S)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl ester ethyl ester::CHEMBL147879 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040386 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040386&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 9895340 103972443 CHEMBL147879 ZINC14279387 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50286632 COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC InChI=1S/C29H34N4O6/c1-36-23-12-10-20(15-25(23)38-3)17-27(34)33-29(30)32-22(14-19-8-6-5-7-9-19)28(35)31-18-21-11-13-24(37-2)26(16-21)39-4/h5-13,15-16,22H,14,17-18H2,1-4H3,(H,31,35)(H3,30,32,33,34)/t22-/m1/s1 IZIUZEPBXLRZLW-JOCHJYFZSA-N 50055908 CHEMBL3321925::US9884814, Compound 141 Cathepsin D Bos taurus 330 ChEMBL 10.1016/j.bmcl.2014.07.054 10.7270/Q2W95BV1 25086681 Grädler, U; Czodrowski, P; Tsaklakidis, C; Klein, M; Werkmann, D; Lindemann, S; Maskos, K; Leuthner, B Merck KGaA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50055908 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50055908&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 2RZ 4OD9 76871908 103952362 CHEMBL3321925 ZINC36080272 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50286633 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)ccc1F InChI=1S/C28H37FN4O5/c1-36-23-12-10-19(14-25(23)38-3)16-26(34)33-28(30)32-22(13-18-7-5-4-6-8-18)27(35)31-17-20-9-11-21(29)24(15-20)37-2/h9-12,14-15,18,22H,4-8,13,16-17H2,1-3H3,(H,31,35)(H3,30,32,33,34)/t22-/m1/s1 BJXPQZHOHBSDED-JOCHJYFZSA-N 50055907 CHEMBL3321928::US9884814, Compound 60 Cathepsin D Bos taurus 500 ChEMBL 10.1016/j.bmcl.2014.07.054 10.7270/Q2W95BV1 25086681 Grädler, U; Czodrowski, P; Tsaklakidis, C; Klein, M; Werkmann, D; Lindemann, S; Maskos, K; Leuthner, B Merck KGaA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50055907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50055907&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90285136 103952361 CHEMBL3321928 ZINC36080287 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50286634 COc1cc(CNC(=O)[C@@H](CC(C)C)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)ccc1F InChI=1S/C25H33FN4O5/c1-15(2)10-19(24(32)28-14-17-6-8-18(26)21(12-17)34-4)29-25(27)30-23(31)13-16-7-9-20(33-3)22(11-16)35-5/h6-9,11-12,15,19H,10,13-14H2,1-5H3,(H,28,32)(H3,27,29,30,31)/t19-/m1/s1 DMSOTNGMODOHJR-LJQANCHMSA-N 50055892 CHEMBL3321931::US9884814, Compound 44 Cathepsin D Bos taurus 620 ChEMBL 10.1016/j.bmcl.2014.07.054 10.7270/Q2W95BV1 25086681 Grädler, U; Czodrowski, P; Tsaklakidis, C; Klein, M; Werkmann, D; Lindemann, S; Maskos, K; Leuthner, B Merck KGaA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50055892 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50055892&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90294431 103952346 CHEMBL3321931 ZINC13760783 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50286635 COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)NCc2ccc(cc2)-c2nnn[nH]2)cc1OC InChI=1S/C28H36N8O4/c1-39-23-13-10-20(15-24(23)40-2)16-25(37)32-28(29)31-22(14-18-6-4-3-5-7-18)27(38)30-17-19-8-11-21(12-9-19)26-33-35-36-34-26/h8-13,15,18,22H,3-7,14,16-17H2,1-2H3,(H,30,38)(H3,29,31,32,37)(H,33,34,35,36)/t22-/m1/s1 AEWGFSGAPHPPHI-JOCHJYFZSA-N 50055931 CHEMBL3321933::US9884814, Compound 272 Cathepsin D Bos taurus 1800 ChEMBL 10.1016/j.bmcl.2014.07.054 10.7270/Q2W95BV1 25086681 Grädler, U; Czodrowski, P; Tsaklakidis, C; Klein, M; Werkmann, D; Lindemann, S; Maskos, K; Leuthner, B Merck KGaA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50055931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50055931&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90285792 103952385 CHEMBL3321933 ZINC36080299 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50286636 COc1cc(CNC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(OC)c(OC)cc2Br)ccc1F InChI=1S/C28H36BrFN4O5/c1-37-23-12-18(9-10-21(23)30)16-32-27(36)22(11-17-7-5-4-6-8-17)33-28(31)34-26(35)14-19-13-24(38-2)25(39-3)15-20(19)29/h9-10,12-13,15,17,22H,4-8,11,14,16H2,1-3H3,(H,32,36)(H3,31,33,34,35)/t22-/m1/s1 ASRZOKKKEGIGOW-JOCHJYFZSA-N 50055925 CHEMBL3321939::US9884814, Compound 99 Cathepsin D Bos taurus 900 ChEMBL 10.1016/j.bmcl.2014.07.054 10.7270/Q2W95BV1 25086681 Grädler, U; Czodrowski, P; Tsaklakidis, C; Klein, M; Werkmann, D; Lindemann, S; Maskos, K; Leuthner, B Merck KGaA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50055925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50055925&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90285610 103952379 CHEMBL3321939 ZINC36080283 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50482553 CC(C)[C@@H](O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)c1cc2ccccc2[nH]1 InChI=1S/C29H41N5O4/c1-18(2)26(35)15-27(36)23(12-19-8-4-3-5-9-19)33-29(38)25(14-21-16-30-17-31-21)34-28(37)24-13-20-10-6-7-11-22(20)32-24/h6-7,10-11,13,16-19,23,25-27,32,35-36H,3-5,8-9,12,14-15H2,1-2H3,(H,30,31)(H,33,38)(H,34,37)/t23-,25-,26-,27-/m0/s1 WOVROQCAJRMPKP-MNUOIFNESA-N 50289714 1H-Indole-2-carboxylic acid [(S)-1-((1S,2S,4S)-1-cyclohexylmethyl-2,4-dihydroxy-5-methyl-hexylcarbamoyl)-2-(1H-imidazol-4-yl)-ethyl]-amide::CHEMBL54677 Cathepsin D Bos taurus >100000 ChEMBL 10.1016/S0960-894X(97)00323-5 10.7270/Q2K64J20 Yamada, Y; Ando, K; Komiyama, K; Shibata, S; Nakamura, I; Hayashi, Y; Ikegami, K; Uchida, I TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289714&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10436816 104131285 CHEMBL54677 ZINC03922690 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517645 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)C[C@H](Cc1ccc(OC)c(OCCCOC)c1)C(C)C InChI=1S/C27H48N2O5/c1-7-8-12-29-27(31)20(4)15-24(30)23(28)18-22(19(2)3)16-21-10-11-25(33-6)26(17-21)34-14-9-13-32-5/h10-11,17,19-20,22-24,30H,7-9,12-16,18,28H2,1-6H3,(H,29,31)/t20-,22+,23+,24+/m1/s1 HMXUWQWZWZLSAO-KAMZKSLDSA-N 17949 (2R,4S,5S,7S)-5-amino-N-butyl-4-hydroxy-7-{[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl}-2,8-dimethylnonanamide::8-phenyl-octanecarboxamide peptidomimetic, 38a::Renin nonpeptide inhibitor, 9 Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=17949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=17949&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search C61 2V10 9982638 46518082 ZINC04393139 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517646 COCCCOc1cc(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)ccc1OC InChI=1S/C30H53N3O6/c1-19(2)22(14-21-10-11-26(38-8)27(15-21)39-13-9-12-37-7)16-24(31)25(34)17-23(20(3)4)28(35)33-18-30(5,6)29(32)36/h10-11,15,19-20,22-25,34H,9,12-14,16-18,31H2,1-8H3,(H2,32,36)(H,33,35)/t22-,23-,24-,25-/m0/s1 UXOWGYHJODZGMF-QORCZRPOSA-N 17950 (2S,4S,5S,7S)-5-amino-N-(2-carbamoyl-2,2-dimethylethyl)-4-hydroxy-7-{[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl}-8-methyl-2-(propan-2-yl)nonanamide::ALISKIREN FUMARATE::Aliskiren::Aliskiren Hemifumarate::CHEMBL1639::Rasilez::TEKTURNA Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=17950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=17950&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search C41 2V0Z 5493444 46509572 601027 CHEMBL1639 DB09026 4812 ZINC04393164 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517647 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(OCCCOC)c1 InChI=1S/C26H45N3O6/c1-7-8-12-28-25(31)19(4)15-22(30)21(27)17-29(18(2)3)26(32)20-10-11-23(34-6)24(16-20)35-14-9-13-33-5/h10-11,16,18-19,21-22,30H,7-9,12-15,17,27H2,1-6H3,(H,28,31)/t19-,21+,22+/m1/s1 UZTWTKGFIWIYEJ-HJNYFJLDSA-N 50298191 CHEMBL557063::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-N-isopropyl-4-methoxy-3-(3-methoxypropoxy)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298191&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44517740 104139722 CHEMBL557063 ZINC62188906 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517648 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(CCCCOC)c1 InChI=1S/C27H47N3O5/c1-7-8-14-29-26(32)20(4)16-24(31)23(28)18-30(19(2)3)27(33)22-12-13-25(35-6)21(17-22)11-9-10-15-34-5/h12-13,17,19-20,23-24,31H,7-11,14-16,18,28H2,1-6H3,(H,29,32)/t20-,23+,24+/m1/s1 VJOSOVQVENJMHT-QDSKXPNFSA-N 50298192 CHEMBL561407::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-N-isopropyl-4-methoxy-3-(4-methoxybutyl)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298192&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45269509 104139723 CHEMBL561407 ZINC62188909 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517649 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(\C=C\CCOC)c1 InChI=1S/C27H45N3O5/c1-7-8-14-29-26(32)20(4)16-24(31)23(28)18-30(19(2)3)27(33)22-12-13-25(35-6)21(17-22)11-9-10-15-34-5/h9,11-13,17,19-20,23-24,31H,7-8,10,14-16,18,28H2,1-6H3,(H,29,32)/b11-9+/t20-,23+,24+/m1/s1 VZVRQYQYNAGBRS-IZGRCODESA-N 50298193 CHEMBL557064::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-N-isopropyl-4-methoxy-3-((E)-4-methoxybut-1-enyl)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298193&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45272903 104139724 CHEMBL557064 ZINC62188913 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517650 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(CNC(=O)OC)c1 InChI=1S/C25H42N4O6/c1-7-8-11-27-23(31)17(4)12-21(30)20(26)15-29(16(2)3)24(32)18-9-10-22(34-5)19(13-18)14-28-25(33)35-6/h9-10,13,16-17,20-21,30H,7-8,11-12,14-15,26H2,1-6H3,(H,27,31)(H,28,33)/t17-,20+,21+/m1/s1 BPPJAUKVTMVYPP-QMMLZNLJSA-N 50298194 CHEMBL561141::methyl 5-(((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)(isopropyl)carbamoyl)-2-methoxybenzylcarbamate Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298194&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45268578 104139725 CHEMBL561141 ZINC62188917 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517651 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(OC)c(CCNC(=O)OC)c1 InChI=1S/C26H44N4O6/c1-7-8-12-28-24(32)18(4)14-22(31)21(27)16-30(17(2)3)25(33)20-9-10-23(35-5)19(15-20)11-13-29-26(34)36-6/h9-10,15,17-18,21-22,31H,7-8,11-14,16,27H2,1-6H3,(H,28,32)(H,29,34)/t18-,21+,22+/m1/s1 ZSZRPUJYXHTOID-COPCDDAFSA-N 50298195 CHEMBL564448::methyl 5-(((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)(isopropyl)carbamoyl)-2-methoxyphenethylcarbamate Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298195&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45267708 104139726 CHEMBL564448 ZINC62188921 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517652 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(C)c(OCCCOC)c1 InChI=1S/C26H45N3O5/c1-7-8-12-28-25(31)20(5)15-23(30)22(27)17-29(18(2)3)26(32)21-11-10-19(4)24(16-21)34-14-9-13-33-6/h10-11,16,18,20,22-23,30H,7-9,12-15,17,27H2,1-6H3,(H,28,31)/t20-,22+,23+/m1/s1 LRTCMCOMQSPFJT-PUHATCMVSA-N 50298196 CHEMBL562605::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-N-isopropyl-3-(3-methoxypropoxy)-4-methylbenzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298196&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45273762 104139727 CHEMBL562605 ZINC62188931 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517653 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(CC)c(OCCCOC)c1 InChI=1S/C27H47N3O5/c1-7-9-13-29-26(32)20(5)16-24(31)23(28)18-30(19(3)4)27(33)22-12-11-21(8-2)25(17-22)35-15-10-14-34-6/h11-12,17,19-20,23-24,31H,7-10,13-16,18,28H2,1-6H3,(H,29,32)/t20-,23+,24+/m1/s1 ARBJTFAFEPWZAO-QDSKXPNFSA-N 50298197 CHEMBL550066::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-4-ethyl-N-isopropyl-3-(3-methoxypropoxy)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298197&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45271083 104139728 CHEMBL550066 ZINC62188934 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517654 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(Br)c(OCCCOC)c1 InChI=1S/C25H42BrN3O5/c1-6-7-11-28-24(31)18(4)14-22(30)21(27)16-29(17(2)3)25(32)19-9-10-20(26)23(15-19)34-13-8-12-33-5/h9-10,15,17-18,21-22,30H,6-8,11-14,16,27H2,1-5H3,(H,28,31)/t18-,21+,22+/m1/s1 FLYYEPGUPIYISO-COPCDDAFSA-N 50298198 CHEMBL550673::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-4-bromo-N-isopropyl-3-(3-methoxypropoxy)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298198&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45271093 104139729 CHEMBL550673 ZINC70631613 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517655 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(C#C)c(OCCCOC)c1 InChI=1S/C27H43N3O5/c1-7-9-13-29-26(32)20(5)16-24(31)23(28)18-30(19(3)4)27(33)22-12-11-21(8-2)25(17-22)35-15-10-14-34-6/h2,11-12,17,19-20,23-24,31H,7,9-10,13-16,18,28H2,1,3-6H3,(H,29,32)/t20-,23+,24+/m1/s1 ODNZUSLIDNYDNQ-QDSKXPNFSA-N 50298199 CHEMBL561342::N-((2S,3S,5R)-2-amino-6-(butylamino)-3-hydroxy-5-methyl-6-oxohexyl)-4-ethynyl-N-isopropyl-3-(3-methoxypropoxy)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298199&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45268584 104139730 CHEMBL561342 ZINC62188939 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517656 CCCCNC(=O)[C@@H](C[C@H](O)[C@@H](N)CN(C(C)C)C(=O)c1ccc(CC)c(OCCCOC)c1)C(C)C InChI=1S/C29H51N3O5/c1-8-10-14-31-28(34)24(20(3)4)18-26(33)25(30)19-32(21(5)6)29(35)23-13-12-22(9-2)27(17-23)37-16-11-15-36-7/h12-13,17,20-21,24-26,33H,8-11,14-16,18-19,30H2,1-7H3,(H,31,34)/t24-,25-,26-/m0/s1 NGPMIGMGKFRAJT-GSDHBNRESA-N 50298200 CHEMBL550005::N-((2S,3S,5S)-2-amino-5-(butylcarbamoyl)-3-hydroxy-6-methylheptyl)-4-ethyl-N-isopropyl-3-(3-methoxypropoxy)benzamide Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298200&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45270275 104139731 CHEMBL550005 ZINC62188945 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517657 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)S(=O)(=O)c1ccc(OC)c(OCCCOC)c1 InChI=1S/C25H45N3O7S/c1-7-8-12-27-25(30)19(4)15-22(29)21(26)17-28(18(2)3)36(31,32)20-10-11-23(34-6)24(16-20)35-14-9-13-33-5/h10-11,16,18-19,21-22,29H,7-9,12-15,17,26H2,1-6H3,(H,27,30)/t19-,21+,22+/m1/s1 HKGJUUIKGOANAU-HJNYFJLDSA-N 50298201 (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-(N-isopropyl-4-methoxy-3-(3-methoxypropoxy)phenylsulfonamido)-2-methylhexanamide::CHEMBL560085 Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298201&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45267713 104139732 CHEMBL560085 ZINC62188949 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517658 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(C(C)C)S(=O)(=O)c1ccc(OC)cc1 InChI=1S/C21H37N3O5S/c1-6-7-12-23-21(26)16(4)13-20(25)19(22)14-24(15(2)3)30(27,28)18-10-8-17(29-5)9-11-18/h8-11,15-16,19-20,25H,6-7,12-14,22H2,1-5H3,(H,23,26)/t16-,19+,20+/m1/s1 GGIQKEHIZONYJO-UXPWSPDFSA-N 50298202 (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-(N-isopropyl-4-methoxyphenylsulfonamido)-2-methylhexanamide::CHEMBL551279 Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298202&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45271101 104139733 CHEMBL551279 ZINC62188952 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517659 CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CN(Cc1ccc(OC)c(OCCCOC)c1)C(C)C InChI=1S/C26H47N3O5/c1-7-8-12-28-26(31)20(4)15-23(30)22(27)18-29(19(2)3)17-21-10-11-24(33-6)25(16-21)34-14-9-13-32-5/h10-11,16,19-20,22-23,30H,7-9,12-15,17-18,27H2,1-6H3,(H,28,31)/t20-,22+,23+/m1/s1 SZRCOQGNTQABOL-PUHATCMVSA-N 50298203 (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-(isopropyl(4-methoxy-3-(3-methoxypropoxy)benzyl)amino)-2-methylhexanamide::CHEMBL550412 Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298203&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 45270278 104139734 CHEMBL550412 ZINC62188956 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50517660 COCCCOc1cc(CN(C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)ccc1OC InChI=1S/C29H52N4O6/c1-19(2)22(27(35)32-18-29(5,6)28(31)36)15-24(34)23(30)17-33(20(3)4)16-21-10-11-25(38-8)26(14-21)39-13-9-12-37-7/h10-11,14,19-20,22-24,34H,9,12-13,15-18,30H2,1-8H3,(H2,31,36)(H,32,35)/t22-,23-,24-/m0/s1 GKGIFKZUIBKKDS-HJOGWXRNSA-N 50298190 (2S,4S,5S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-2-isopropyl-6-(isopropyl(4-methoxy-3-(3-methoxypropoxy)benzyl)amino)hexanamide::CHEMBL560486 Cathepsin D Bos taurus >100000 ChEMBL 10.1016/j.bmcl.2009.05.128 10.7270/Q2F18ZRG 19615901 Yamaguchi, Y; Menear, K; Cohen, NC; Mah, R; Cumin, F; Schnell, C; Wood, JM; Maibaum, J Nagasaki International University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50298190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50298190&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44517739 104139721 CHEMBL560486 ZINC70631612 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760088 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1 InChI=1S/C33H53N7O6S2/c1-22(2)17-29(41)30(42)26(18-23-9-5-3-6-10-23)37-31(43)27(20-25-21-47-33(34)36-25)38-32(44)28(19-24-11-7-4-8-12-24)39-48(45,46)40-15-13-35-14-16-40/h4,7-8,11-12,21-23,26-30,35,39,41-42H,3,5-6,9-10,13-20H2,1-2H3,(H2,34,36)(H,37,43)(H,38,44)/t26-,27-,28-,29-,30+/m0/s1 BZCJAFFUHZRXMP-VFFRCKCKSA-N 50006848 CHEMBL88091::N-[2-(2-Amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethyl]-3-phenyl-2-(piperazine-1-sulfonylamino)-propionamide Cathepsin D Bos taurus 8900 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006848&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320564 103920166 CHEMBL88091 ZINC03920094 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760089 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C33H52N6O7S2/c1-22(2)17-29(40)30(41)26(18-23-9-5-3-6-10-23)36-31(42)27(20-25-21-47-33(34)35-25)37-32(43)28(19-24-11-7-4-8-12-24)38-48(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-23,26-30,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H2,34,35)(H,36,42)(H,37,43)/t26-,27+,28-,29-,30+/m0/s1 QGJKHQRFJGLJLV-PBIKNJLJSA-N 50006847 CHEMBL86374::N-[2-(2-Amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 14500 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006847&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320330 103920165 CHEMBL86374 ZINC26576966 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760095 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)c1csc(N)n1 InChI=1S/C32H50N6O7S2/c1-21(2)17-27(39)29(40)24(18-22-9-5-3-6-10-22)34-31(42)28(26-20-46-32(33)35-26)36-30(41)25(19-23-11-7-4-8-12-23)37-47(43,44)38-13-15-45-16-14-38/h4,7-8,11-12,20-22,24-25,27-29,37,39-40H,3,5-6,9-10,13-19H2,1-2H3,(H2,33,35)(H,34,42)(H,36,41)/t24-,25-,27-,28?,29+/m0/s1 PZESREMCLYKFKF-XLZVNLJPSA-N 50006843 CHEMBL314066::N-[(2-Amino-thiazol-4-yl)-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-methyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 86 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006843&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320565 103920161 CHEMBL314066 ZINC26574792 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760097 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C36H54N4O7S/c1-26(2)22-33(41)34(42)30(23-27-12-6-3-7-13-27)37-35(43)31(24-28-14-8-4-9-15-28)38-36(44)32(25-29-16-10-5-11-17-29)39-48(45,46)40-18-20-47-21-19-40/h4-5,8-11,14-17,26-27,30-34,39,41-42H,3,6-7,12-13,18-25H2,1-2H3,(H,37,43)(H,38,44)/t30-,31-,32-,33-,34+/m0/s1 OPQKDEDGEANJNG-PJRHAEEISA-N 50006851 CHEMBL263531::N-[1-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-phenyl-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 270 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006851&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320156 103920169 CHEMBL263531 ZINC26577107 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760099 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)C(F)(F)C(=O)NCCN2CCOCC2)cs1 InChI=1S/C36H54F2N8O8S2/c37-36(38,34(50)40-11-12-45-13-17-53-18-14-45)31(47)28(21-25-7-3-1-4-8-25)42-32(48)29(23-27-24-55-35(39)41-27)43-33(49)30(22-26-9-5-2-6-10-26)44-56(51,52)46-15-19-54-20-16-46/h2,5-6,9-10,24-25,28-31,44,47H,1,3-4,7-8,11-23H2,(H2,39,41)(H,40,50)(H,42,48)(H,43,49)/t28-,29-,30-,31+/m0/s1 AWFZFBWKAUOZBA-XHPANXIASA-N 50006849 4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-hydroxy-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL430634 Cathepsin D Bos taurus 95000 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006849&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990027 103920167 CHEMBL430634 ZINC95611892 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760101 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(=O)C(F)(F)C(=O)NCCN2CCOCC2)cs1 InChI=1S/C36H52F2N8O8S2/c37-36(38,34(50)40-11-12-45-13-17-53-18-14-45)31(47)28(21-25-7-3-1-4-8-25)42-32(48)29(23-27-24-55-35(39)41-27)43-33(49)30(22-26-9-5-2-6-10-26)44-56(51,52)46-15-19-54-20-16-46/h2,5-6,9-10,24-25,28-30,44H,1,3-4,7-8,11-23H2,(H2,39,41)(H,40,50)(H,42,48)(H,43,49)/t28-,29-,30-/m0/s1 VALJKRUIJYUEIF-DTXPUJKBSA-N 50006856 4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; Hydrate::CHEMBL405227 Cathepsin D Bos taurus 3700 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006856&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990028 103920174 CHEMBL405227 ZINC95540359 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760102 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C34H54N6O7S2/c1-23(2)19-30(41)31(42)28(20-24-9-5-3-6-10-24)38-32(43)27(14-13-26-22-48-34(35)36-26)37-33(44)29(21-25-11-7-4-8-12-25)39-49(45,46)40-15-17-47-18-16-40/h4,7-8,11-12,22-24,27-31,39,41-42H,3,5-6,9-10,13-21H2,1-2H3,(H2,35,36)(H,37,44)(H,38,43)/t27-,28-,29-,30-,31+/m0/s1 BGQTXDXVVKCELD-STVCLKQXSA-N 50006852 4-(2-Amino-thiazol-4-yl)-N-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-butyramide::CHEMBL87389 Cathepsin D Bos taurus 834 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006852&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320175 103920170 CHEMBL87389 ZINC26576125 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760103 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C33H52N6O7S2/c1-22(2)17-29(40)30(41)26(18-23-9-5-3-6-10-23)36-31(42)27(20-25-21-47-33(34)35-25)37-32(43)28(19-24-11-7-4-8-12-24)38-48(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-23,26-30,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H2,34,35)(H,36,42)(H,37,43)/t26-,27-,28-,29-,30+/m0/s1 QGJKHQRFJGLJLV-VFFRCKCKSA-N 50006844 (S)-N-[(S)-2-(2-Amino-thiazol-4-yl)-1-((1S,2R,3S)-1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide::(S)-N-{(1S,2S)-2-(2-Amino-thiazol-4-yl)-1-[1-((S)-cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexylcarbamoyl]-ethyl}-2-((R)-morpholine-4-sulfonylamino)-3-phenyl-propionamide::CHEMBL34894::CI-992::N-[2-(2-Amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 1250 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006844&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 9875002 103920162 CHEMBL34894 ZINC03920090 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760107 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C33H52N6O7S/c1-23(2)17-30(40)31(41)27(18-24-9-5-3-6-10-24)36-32(42)28(20-26-21-34-22-35-26)37-33(43)29(19-25-11-7-4-8-12-25)38-47(44,45)39-13-15-46-16-14-39/h4,7-8,11-12,21-24,27-31,38,40-41H,3,5-6,9-10,13-20H2,1-2H3,(H,34,35)(H,36,42)(H,37,43)/t27-,28-,29-,30-,31+/m0/s1 ZJDRDAKKIABCDV-STVCLKQXSA-N 50006858 CHEMBL315380::N-[1-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-(1H-imidazol-4-yl)-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 51800 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006858 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006858&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15659179 103920176 CHEMBL315380 ZINC25990903 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760108 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)N1CCOCC1 InChI=1S/C34H52N6O7S2/c1-22(2)16-30(41)31(42)27(17-23-8-4-3-5-9-23)37-32(43)28(19-26-21-48-34(35)36-26)38-33(44)29-18-24-10-6-7-11-25(24)20-40(29)49(45,46)39-12-14-47-15-13-39/h6-7,10-11,21-23,27-31,41-42H,3-5,8-9,12-20H2,1-2H3,(H2,35,36)(H,37,43)(H,38,44)/t27-,28-,29-,30-,31+/m0/s1 DFJFFIIAHYRMCJ-STVCLKQXSA-N 50006859 2-((R)-(S)-Morpholine-4-sulfonyl)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid {(S)-2-(2-amino-thiazol-4-yl)-1-[(S)-1-((S)-cyclohexylmethyl)-2,3-dihydroxy-5-methyl-hexylcarbamoyl]-ethyl}-amide::2-(Morpholine-4-sulfonyl)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid [2-(2-amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethyl]-amide::CHEMBL60610 Cathepsin D Bos taurus 30000 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006859 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006859&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990021 103920177 CHEMBL60610 ZINC03981047 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760110 COc1ccc(C[C@H](NC(=O)CC(C)(C)N)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1 InChI=1S/C35H56N6O6/c1-22(2)15-30(42)32(44)27(16-23-9-7-6-8-10-23)40-34(46)29(18-25-20-37-21-38-25)41-33(45)28(39-31(43)19-35(3,4)36)17-24-11-13-26(47-5)14-12-24/h11-14,20-23,27-30,32,42,44H,6-10,15-19,36H2,1-5H3,(H,37,38)(H,39,43)(H,40,46)(H,41,45)/t27-,28-,29-,30-,32+/m0/s1 KQXVERRYBYGQJZ-WRPDIKACSA-N 50006202 3-Amino-N-[1-[1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-(1H-imidazol-4-yl)-ethylcarbamoyl]-2-(4-methoxy-phenyl)-ethyl]-3-methyl-butyramide::A-64662::CHEMBL300337::ENALKIREN Cathepsin D Bos taurus >100000 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006202&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 60594 103919626 CHEMBL300337 DB03395 ZINC53683872 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760115 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NP(=O)(OC(C)C)OC(C)C InChI=1S/C35H58N5O7PS/c1-22(2)17-31(41)32(42)28(18-25-13-9-7-10-14-25)38-33(43)29(20-27-21-49-35(36)37-27)39-34(44)30(19-26-15-11-8-12-16-26)40-48(45,46-23(3)4)47-24(5)6/h8,11-12,15-16,21-25,28-32,41-42H,7,9-10,13-14,17-20H2,1-6H3,(H2,36,37)(H,38,43)(H,39,44)(H,40,45)/t28-,29-,30-,31-,32+/m0/s1 IKQAPARFDOBBMW-QEUNAIBPSA-N 50006860 CHEMBL85672::{1-[2-(2-Amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethyl}-phosphoramidic acid diisopropyl ester Cathepsin D Bos taurus 33 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006860 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006860&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320059 103920178 CHEMBL85672 ZINC26570286 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760116 COc1ccc(C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](Cc2csc(N)n2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1 InChI=1S/C34H54N6O8S2/c1-22(2)17-30(41)31(42)27(18-23-7-5-4-6-8-23)37-32(43)28(20-25-21-49-34(35)36-25)38-33(44)29(19-24-9-11-26(47-3)12-10-24)39-50(45,46)40-13-15-48-16-14-40/h9-12,21-23,27-31,39,41-42H,4-8,13-20H2,1-3H3,(H2,35,36)(H,37,43)(H,38,44)/t27-,28-,29-,30-,31+/m0/s1 QLXHRYKGTCSNKH-STVCLKQXSA-N 50006845 CHEMBL316208::N-[2-(2-Amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethyl]-3-(4-methoxy-phenyl)-2-(morpholine-4-sulfonylamino)-propionamide Cathepsin D Bos taurus 2170 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006845&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320162 103920163 CHEMBL316208 ZINC03920091 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760121 CCOC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C32H44F2N6O8S2/c1-2-48-30(44)32(33,34)27(41)24(17-21-9-5-3-6-10-21)37-28(42)25(19-23-20-49-31(35)36-23)38-29(43)26(18-22-11-7-4-8-12-22)39-50(45,46)40-13-15-47-16-14-40/h4,7-8,11-12,20-21,24-26,39H,2-3,5-6,9-10,13-19H2,1H3,(H2,35,36)(H,37,42)(H,38,43)/t24-,25-,26-/m0/s1 ZEYSVLZKQXCERB-GSDHBNRESA-N 50006846 4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-oxo-pentanoic acid ethyl ester::CHEMBL431217 Cathepsin D Bos taurus 6400 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006846&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990029 103920164 CHEMBL431217 ZINC95614421 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760123 CCCCNC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)CS(=O)(=O)C(C)(C)C)C(C)C InChI=1S/C39H63N5O6S/c1-7-8-19-41-37(47)32(27(2)3)23-35(45)33(21-29-17-13-10-14-18-29)43-38(48)34(22-31-24-40-26-42-31)44-36(46)30(20-28-15-11-9-12-16-28)25-51(49,50)39(4,5)6/h9,11-12,15-16,24,26-27,29-30,32-35,45H,7-8,10,13-14,17-23,25H2,1-6H3,(H,40,42)(H,41,47)(H,43,48)(H,44,46)/t30-,32+,33+,34+,35+/m1/s1 GGKXIITZBSPCQP-IZIWAXSGSA-N 17941 (2S,4S,5S)-5-[(2S)-2-[(2S)-2-benzyl-3-[(2-methylpropane-2-)sulfonyl]propanamido]-3-(1H-imidazol-4-yl)propanamido]-N-butyl-6-cyclohexyl-4-hydroxy-2-(propan-2-yl)hexanamide::CGP 38560 Cathepsin D Bos taurus 1380 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=17941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=17941&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search C60 1RNE 448382 46518075 ZINC03917787 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760124 COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26-,27+,28+/m0/s1 IEWAGORIVPFRDB-APNLASKRSA-N 50006853 CHEMBL315211::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus 35 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006853&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14861679 103920171 CHEMBL315211 ZINC26576268 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760128 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)CC(=O)NCCN(CCO)CCO)cs1 InChI=1S/C36H58N8O9S2/c37-36-39-28(25-54-36)23-30(41-35(50)31(22-27-9-5-2-6-10-27)42-55(51,52)44-15-19-53-20-16-44)34(49)40-29(21-26-7-3-1-4-8-26)32(47)24-33(48)38-11-12-43(13-17-45)14-18-46/h2,5-6,9-10,25-26,29-32,42,45-47H,1,3-4,7-8,11-24H2,(H2,37,39)(H,38,48)(H,40,49)(H,41,50)/t29-,30-,31-,32-/m0/s1 XSBBDWMFZSROFA-YDPTYEFTSA-N 50006857 4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-3-hydroxy-pentanoic acid {2-[bis-(2-hydroxy-ethyl)-amino]-ethyl}-amide::CHEMBL316218 Cathepsin D Bos taurus 25000 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006857&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990024 103920175 CHEMBL316218 ZINC95540358 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760129 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cscn1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C33H51N5O7S2/c1-23(2)17-30(39)31(40)27(18-24-9-5-3-6-10-24)35-32(41)28(20-26-21-46-22-34-26)36-33(42)29(19-25-11-7-4-8-12-25)37-47(43,44)38-13-15-45-16-14-38/h4,7-8,11-12,21-24,27-31,37,39-40H,3,5-6,9-10,13-20H2,1-2H3,(H,35,41)(H,36,42)/t27-,28-,29-,30-,31+/m0/s1 VAEFWYXBOVOBHR-STVCLKQXSA-N 50006850 CHEMBL313063::N-[1-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-thiazol-4-yl-ethyl]-2-(morpholine-4-sulfonylamino)-3-phenyl-propionamide Cathepsin D Bos taurus 130 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006850&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990030 103920168 CHEMBL313063 ZINC26569318 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50760130 CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1csc(N)n1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C34H53N5O6S/c1-21(2)16-28(40)29(41)25(17-22-12-8-6-9-13-22)37-31(43)27(19-24-20-46-32(35)36-24)38-30(42)26(18-23-14-10-7-11-15-23)39-33(44)45-34(3,4)5/h7,10-11,14-15,20-22,25-29,40-41H,6,8-9,12-13,16-19H2,1-5H3,(H2,35,36)(H,37,43)(H,38,42)(H,39,44)/t25-,26-,27-,28-,29+/m0/s1 MNCJMPPTISDLKZ-MYHRABSESA-N 50006864 CHEMBL420417::{1-[2-(2-Amino-thiazol-4-yl)-1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 763 ChEMBL 10.1021/jm00092a006 10.7270/Q2ZK5H8V 1635057 Patt, WC; Hamilton, HW; Taylor, MD; Ryan, MJ; Taylor, DG; Connolly, CJ; Doherty, AM; Klutchko, SR; Sircar, I; Steinbaugh, BA Parke-Davis Pharmaceutical Research Division of Warner-Lambert Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006864 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006864&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44320331 103920182 CHEMBL420417 ZINC26576650 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50746717 CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(C)C)C(=O)NCc1ccccn1 InChI=1S/C50H75N9O8/c1-11-33(6)43(47(64)53-29-35-20-15-16-22-52-35)57-44(61)37(32(4)5)27-42(60)38(24-31(2)3)55-46(63)41(26-36-28-51-30-54-36)58(10)48(65)39(25-34-18-13-12-14-19-34)56-45(62)40-21-17-23-59(40)49(66)67-50(7,8)9/h12-16,18-20,22,28,30-33,37-43,60H,11,17,21,23-27,29H2,1-10H3,(H,51,54)(H,53,64)(H,55,63)(H,56,62)(H,57,61) SASWSEQJAITMKS-UHFFFAOYSA-N 50024156 2-(1-{[1-(2-Hydroxy-1-isobutyl-5-methyl-4-{2-methyl-1-[(pyridin-2-ylmethyl)-carbamoyl]-butylcarbamoyl}-hexylcarbamoyl)-2-(3H-imidazol-4-yl)-ethyl]-methyl-carbamoyl}-2-phenyl-ethylcarbamoyl)-pyrrolidine-1-carboxylic acid tert-butyl ester::CHEMBL303323::Ditekiren Cathepsin D Bos taurus 6300 ChEMBL 10.1021/jm00160a049 10.7270/Q2251JRT 3531518 Thaisrivongs, S; Pals, DT; Harris, DW; Kati, WM; Turner, SR TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50024156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50024156&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 5464201 103934447 CHEMBL303323 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758326 CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)OC(C)C InChI=1S/C33H54N4O9S/c1-22(2)19-28(38)30(39)26(20-24-11-7-5-8-12-24)34-32(41)29(33(42)46-23(3)4)35-31(40)27(21-25-13-9-6-10-14-25)36-47(43,44)37-15-17-45-18-16-37/h6,9-10,13-14,22-24,26-30,36,38-39H,5,7-8,11-12,15-21H2,1-4H3,(H,34,41)(H,35,40)/t26-,27-,28+,29?,30+/m0/s1 FDETZHYAYLHPRH-XLJRMFMJSA-N 50012249 CHEMBL58256::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid isopropyl ester Cathepsin D Bos taurus 43 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012249&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300918 103924543 CHEMBL58256 ZINC29569124 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758327 CCCCNC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)CS(=O)(=O)C(C)(C)C)C(C)C InChI=1S/C39H63N5O6S/c1-7-8-19-41-37(47)32(27(2)3)23-35(45)33(21-29-17-13-10-14-18-29)43-38(48)34(22-31-24-40-26-42-31)44-36(46)30(20-28-15-11-9-12-16-28)25-51(49,50)39(4,5)6/h9,11-12,15-16,24,26-27,29-30,32-35,45H,7-8,10,13-14,17-23,25H2,1-6H3,(H,40,42)(H,41,47)(H,43,48)(H,44,46)/t30-,32+,33+,34+,35+/m1/s1 GGKXIITZBSPCQP-IZIWAXSGSA-N 17941 (2S,4S,5S)-5-[(2S)-2-[(2S)-2-benzyl-3-[(2-methylpropane-2-)sulfonyl]propanamido]-3-(1H-imidazol-4-yl)propanamido]-N-butyl-6-cyclohexyl-4-hydroxy-2-(propan-2-yl)hexanamide::CGP 38560 Cathepsin D Bos taurus 1300 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=17941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=17941&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search C60 1RNE 448382 46518075 ZINC03917787 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758328 COC(=O)CC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C InChI=1S/C32H52N4O9S/c1-22(2)18-28(37)30(39)25(19-23-10-6-4-7-11-23)33-31(40)26(21-29(38)44-3)34-32(41)27(20-24-12-8-5-9-13-24)35-46(42,43)36-14-16-45-17-15-36/h5,8-9,12-13,22-23,25-28,30,35,37,39H,4,6-7,10-11,14-21H2,1-3H3,(H,33,40)(H,34,41)/t25-,26?,27-,28+,30+/m0/s1 LHRPSJNSUVBZSV-WDZNRITISA-N 50012250 CHEMBL58947::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-3-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-succinamic acid methyl ester Cathepsin D Bos taurus 27 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012250&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300959 103924544 CHEMBL58947 ZINC29568609 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758329 CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)NC(Cc1cnc[nH]1)C(O)=O InChI=1S/C36H55N7O10S/c1-23(2)17-30(44)32(45)27(18-24-9-5-3-6-10-24)39-34(47)31(35(48)40-29(36(49)50)20-26-21-37-22-38-26)41-33(46)28(19-25-11-7-4-8-12-25)42-54(51,52)43-13-15-53-16-14-43/h4,7-8,11-12,21-24,27-32,42,44-45H,3,5-6,9-10,13-20H2,1-2H3,(H,37,38)(H,39,47)(H,40,48)(H,41,46)(H,49,50)/t27-,28-,29?,30+,31?,32+/m0/s1 LCGRSLFZYGRZGX-BDTNELKKSA-N 50012251 2-{2-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-acetylamino}-3-(1H-imidazol-4-yl)-propionic acid::CHEMBL292677 Cathepsin D Bos taurus 51800 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012251 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012251&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44301665 103924545 CHEMBL292677 ZINC95609689 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758330 CCCCCCOC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C InChI=1S/C36H60N4O9S/c1-4-5-6-13-20-49-36(45)32(35(44)37-29(24-27-14-9-7-10-15-27)33(42)31(41)23-26(2)3)38-34(43)30(25-28-16-11-8-12-17-28)39-50(46,47)40-18-21-48-22-19-40/h8,11-12,16-17,26-27,29-33,39,41-42H,4-7,9-10,13-15,18-25H2,1-3H3,(H,37,44)(H,38,43)/t29-,30-,31+,32?,33+/m0/s1 GELLBVGZLHOKSY-WGOIPULFSA-N 50012253 CHEMBL56982::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid hexyl ester Cathepsin D Bos taurus 100 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012253 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012253&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44301266 103924547 CHEMBL56982 ZINC29562643 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758331 CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)OCC=C InChI=1S/C33H52N4O9S/c1-4-17-46-33(42)29(32(41)34-26(21-24-11-7-5-8-12-24)30(39)28(38)20-23(2)3)35-31(40)27(22-25-13-9-6-10-14-25)36-47(43,44)37-15-18-45-19-16-37/h4,6,9-10,13-14,23-24,26-30,36,38-39H,1,5,7-8,11-12,15-22H2,2-3H3,(H,34,41)(H,35,40)/t26-,27-,28+,29?,30+/m0/s1 UGLJRUMYBWSFLY-XLJRMFMJSA-N 50012252 CHEMBL57492::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid allyl ester Cathepsin D Bos taurus >100 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012252 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012252&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44301267 103924546 CHEMBL57492 ZINC29563038 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758332 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)NCCN1CCOCC1 InChI=1S/C34H54N6O10S/c1-48-34(45)31(37-32(43)28(23-26-10-6-3-7-11-26)38-51(46,47)40-16-20-50-21-17-40)33(44)36-27(22-25-8-4-2-5-9-25)29(41)24-30(42)35-12-13-39-14-18-49-19-15-39/h3,6-7,10-11,25,27-29,31,38,41H,2,4-5,8-9,12-24H2,1H3,(H,35,42)(H,36,44)(H,37,43)/t27-,28-,29-,31?/m0/s1 NMIWPNMFASWALT-SJTZDSSUSA-N 50012255 CHEMBL293328::N-[1-Cyclohexylmethyl-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus >1000 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012255 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012255&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14861674 103924549 CHEMBL293328 ZINC29569679 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758333 CC(C)C[C@@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(O)=O InChI=1S/C30H48N4O9S/c1-20(2)17-25(35)27(36)23(18-21-9-5-3-6-10-21)31-29(38)26(30(39)40)32-28(37)24(19-22-11-7-4-8-12-22)33-44(41,42)34-13-15-43-16-14-34/h4,7-8,11-12,20-21,23-27,33,35-36H,3,5-6,9-10,13-19H2,1-2H3,(H,31,38)(H,32,37)(H,39,40)/t23-,24-,25+,26?,27+/m0/s1 AZPJRQASQKKGCQ-VVLGCECJSA-N 50012254 CHEMBL60535::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid Cathepsin D Bos taurus 310 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012254 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012254&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300956 103924548 CHEMBL60535 ZINC29565918 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758338 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C34H50F2N6O10S/c1-50-32(46)28(39-30(44)27(23-25-10-6-3-7-11-25)40-53(48,49)42-16-20-52-21-17-42)31(45)38-26(22-24-8-4-2-5-9-24)29(43)34(35,36)33(47)37-12-13-41-14-18-51-19-15-41/h3,6-7,10-11,24,26-28,40H,2,4-5,8-9,12-23H2,1H3,(H,37,47)(H,38,45)(H,39,44)/t26-,27-,28?/m0/s1 ILVIKHFAJWQSOQ-ZLBDCPSSSA-N 50012257 CHEMBL299252::N-[1-Cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus 515 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012257 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012257&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14861675 103924551 CHEMBL299252 ZINC95609857 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758345 COc1ccc(C[C@H](NC(=O)CC(C)(C)N)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1 InChI=1S/C35H56N6O6/c1-22(2)15-30(42)32(44)27(16-23-9-7-6-8-10-23)40-34(46)29(18-25-20-37-21-38-25)41-33(45)28(39-31(43)19-35(3,4)36)17-24-11-13-26(47-5)14-12-24/h11-14,20-23,27-30,32,42,44H,6-10,15-19,36H2,1-5H3,(H,37,38)(H,39,43)(H,40,46)(H,41,45)/t27-,28-,29-,30-,32+/m0/s1 KQXVERRYBYGQJZ-WRPDIKACSA-N 50006202 3-Amino-N-[1-[1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-(1H-imidazol-4-yl)-ethylcarbamoyl]-2-(4-methoxy-phenyl)-ethyl]-3-methyl-butyramide::A-64662::CHEMBL300337::ENALKIREN Cathepsin D Bos taurus >1000 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006202&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 60594 103919626 CHEMBL300337 DB03395 ZINC53683872 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758349 COC(=O)CCC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C InChI=1S/C33H54N4O9S/c1-23(2)20-29(38)31(40)27(21-24-10-6-4-7-11-24)35-32(41)26(14-15-30(39)45-3)34-33(42)28(22-25-12-8-5-9-13-25)36-47(43,44)37-16-18-46-19-17-37/h5,8-9,12-13,23-24,26-29,31,36,38,40H,4,6-7,10-11,14-22H2,1-3H3,(H,34,42)(H,35,41)/t26?,27-,28-,29+,31+/m0/s1 BGOKTPFTFAGFJJ-LFJUWLIVSA-N 50012247 4-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-4-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-butyric acid methyl ester::CHEMBL291719 Cathepsin D Bos taurus 30 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012247&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300917 103924541 CHEMBL291719 ZINC29568901 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758352 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN1CCOCC1 InChI=1S/C31H50N6O10S/c1-22(2)19-24(26(38)21-27(39)32-9-10-36-11-15-46-16-12-36)33-30(41)28(31(42)45-3)34-29(40)25(20-23-7-5-4-6-8-23)35-48(43,44)37-13-17-47-18-14-37/h4-8,22,24-26,28,35,38H,9-21H2,1-3H3,(H,32,39)(H,33,41)(H,34,40)/t24-,25-,26-,28?/m0/s1 WLTLARBMGKAORP-HVUBRIRVSA-N 50012256 CHEMBL431751::N-{1-[1-Hydroxy-2-(2-morpholin-4-yl-ethylcarbamoyl)-ethyl]-3-methyl-butyl}-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus >1000 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012256 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012256&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14861671 103924550 CHEMBL431751 ZINC29571610 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747002 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1 FAXGPCHRFPCXOO-LXTPJMTPSA-N 912 (3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanamido]propanamido]-6-methylheptanoic acid::CHEMBL296588::Iva-Val-Val-Sta-Ala-Sta-OH::N-[(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl]-4-amino-3-hydroxy-6-methylheptanoic acid::PEPSTATIN::Pepstatine::US9115083, Pepstatin Cathepsin D Bos taurus 0.500000 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=912&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 1IZE,1LS5,1M43,1SME,1W6I,1XDH,2H6T,2QZX,3EMY 5478883 8030793 CHEMBL296588 C03834 ZINC38148052 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747003 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)(C)C)C(C)C InChI=1S/C25H48N4O5/c1-14(2)10-11-26-24(33)18(9)27-21(31)13-20(30)19(12-15(3)4)28-25(34)22(16(5)6)29-23(32)17(7)8/h14-20,22,30H,10-13H2,1-9H3,(H,26,33)(H,27,31)(H,28,34)(H,29,32)/t18?,19?,20-,22+/m0/s1 GYFYDANKVUKCLT-PEVXEQIPSA-N 50025506 3-Hydroxy-4-(2-isobutyrylamino-3-methyl-butyrylamino)-6-methyl-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3392100 Cathepsin D Bos taurus 110 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025506&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725175 103935380 CHEMBL3392100CHEMBL84939 ZINC26568329 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747005 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C32H61N5O5/c1-18(2)13-14-33-30(40)24(12)34-27(39)17-23(11)25(15-19(3)4)35-31(41)29(22(9)10)37-32(42)28(21(7)8)36-26(38)16-20(5)6/h18-25,28-29H,13-17H2,1-12H3,(H,33,40)(H,34,39)(H,35,41)(H,36,38)(H,37,42)/t23-,24?,25?,28-,29?/m1/s1 VBROOHAYFVCWQQ-SQLRZCDXSA-N 50025508 3,6-Dimethyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3392090 Cathepsin D Bos taurus 400 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025508&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725166 103935382 CHEMBL3392090CHEMBL433330 ZINC36295233 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747006 COC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C27H50N4O7/c1-14(2)11-19(20(32)13-22(34)28-18(9)27(37)38-10)29-25(35)24(17(7)8)31-26(36)23(16(5)6)30-21(33)12-15(3)4/h14-20,23-24,32H,11-13H2,1-10H3,(H,28,34)(H,29,35)(H,30,33)(H,31,36)/t18?,19?,20-,23-,24?/m1/s1 VZPLAIXUJYKIOX-GPJOQAIGSA-N 50025509 2-(3-Hydroxy-6-methyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-heptanoylamino)-propionic acid methyl ester::CHEMBL3143644 Cathepsin D Bos taurus 90 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025509&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663544 103935383 CHEMBL84106CHEMBL3143644 ZINC36295197 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747011 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C InChI=1S/C52H81N7O11/c1-30(2)24-37(55-45(62)34(9)53-46(63)38(25-31(3)4)56-47(64)40(28-36-22-18-15-19-23-36)58-51(68)70-52(10,11)12)42(60)29-43(61)54-39(27-35-20-16-14-17-21-35)48(65)59-44(33(7)8)49(66)57-41(26-32(5)6)50(67)69-13/h14-23,30-34,37-42,44,60H,24-29H2,1-13H3,(H,53,63)(H,54,61)(H,55,62)(H,56,64)(H,57,66)(H,58,68)(H,59,65) PQWNFSMMAWCRFG-UHFFFAOYSA-N 50025514 2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-4-methyl-pentanoylamino]-propionylamino}-3-hydroxy-6-methyl-heptanoylamino)-3-phenyl-propionylamino]-3-methyl-butyrylamino}-4-methyl-pentanoic acid methyl ester::CHEMBL3142505 Cathepsin D Bos taurus 5.8 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025514 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025514&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663011 103935388 CHEMBL3142505CHEMBL84879 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747013 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C InChI=1S/C26H50N4O6/c1-15(2)11-12-27-23(33)18(7)28-21(32)14-20(31)19(13-16(3)4)29-24(34)22(17(5)6)30-25(35)36-26(8,9)10/h15-20,22,31H,11-14H2,1-10H3,(H,27,33)(H,28,32)(H,29,34)(H,30,35)/t18?,19?,20-,22-/m1/s1 UDRRUYFFMTVMGM-FLQRSKGTSA-N 50025516 BDBM50028395::CHEMBL167093::[1-(1-{1-Hydroxy-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-3-methyl-butylcarbamoyl)-2-methyl-propyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 2700 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025516&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44378915 103935390 CHEMBL167093CHEMBL81941 ZINC26566877 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747014 CCOC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C25H47N3O6/c1-10-34-21(31)13-19(29)18(11-14(2)3)26-24(32)23(17(8)9)28-25(33)22(16(6)7)27-20(30)12-15(4)5/h14-19,22-23,29H,10-13H2,1-9H3,(H,26,32)(H,27,30)(H,28,33)/t18?,19-,22-,23?/m1/s1 SMVMSLPPAGGLDL-PWIBJQSTSA-N 50025517 3-Hydroxy-6-methyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-heptanoic acid ethyl ester::CHEMBL433050 Cathepsin D Bos taurus 180 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025517&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search IVS 1ME6 444340 103935391 CHEMBL85058CHEMBL433050 ZINC26508888 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747016 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(C)C)C(C)C InChI=1S/C26H50N4O5/c1-15(2)11-12-27-23(33)18(7)28-21(32)14-20(31)19(13-16(3)4)29-24(34)22(17(5)6)30-25(35)26(8,9)10/h15-20,22,31H,11-14H2,1-10H3,(H,27,33)(H,28,32)(H,29,34)(H,30,35)/t18?,19?,20-,22+/m0/s1 YPOJNUPLWCADQV-PEVXEQIPSA-N 50025519 4-[2-(2,2-Dimethyl-propionylamino)-3-methyl-butyrylamino]-3-hydroxy-6-methyl-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::BDBM50028396::CHEMBL165690 Cathepsin D Bos taurus 590 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025519&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44379064 103935393 CHEMBL165690CHEMBL85253 ZINC26566690 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747017 CC(C)CCNC(=O)[C@H](C)NC(=O)CC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C31H57N5O6/c1-17(2)12-13-32-29(40)22(11)33-26(39)16-24(37)23(14-18(3)4)34-30(41)28(21(9)10)36-31(42)27(20(7)8)35-25(38)15-19(5)6/h17-23,27-28H,12-16H2,1-11H3,(H,32,40)(H,33,39)(H,34,41)(H,35,38)(H,36,42)/t22?,23?,27-,28?/m1/s1 COWSGJQEDUJBDF-YXMWBQGZSA-N 50025518 6-Methyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-3-oxo-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3392099 Cathepsin D Bos taurus 25 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025518&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 101589415 103935392 CHEMBL3392099CHEMBL84607 ZINC36295284 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747018 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C InChI=1S/C40H66N6O10/c1-22(2)18-28(31(47)21-32(48)46-33(24(5)6)37(52)44-30(19-23(3)4)38(53)55-12)43-35(50)26(8)41-34(49)25(7)42-36(51)29(20-27-16-14-13-15-17-27)45-39(54)56-40(9,10)11/h13-17,22-26,28-31,33,47H,18-21H2,1-12H3,(H,41,49)(H,42,51)(H,43,50)(H,44,52)(H,45,54)(H,46,48) QVBSKGAQZDHDSF-UHFFFAOYSA-N 50025513 2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-propionylamino]-propionylamino}-3-hydroxy-6-methyl-heptanoylamino)-3-methyl-butyrylamino]-4-methyl-pentanoic acid methyl ester::CHEMBL3142506 Cathepsin D Bos taurus 12 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025513 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025513&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663012 103935387 CHEMBL3142506CHEMBL84056 ZINC95544614 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747021 [Cl-].CC(C)CCNC(=O)[C@H](C)NC(=O)C([S+](C)C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C33H61N5O6S/c1-18(2)14-15-34-30(41)23(11)35-33(44)29(45(12)13)28(40)24(16-19(3)4)36-31(42)27(22(9)10)38-32(43)26(21(7)8)37-25(39)17-20(5)6/h18-24,26-27,29H,14-17H2,1-13H3,(H4-,34,35,36,37,38,39,41,42,43,44)/p+1/t23?,24?,26-,27?,29?/m1/s1 WDDOIBQZWCBRCT-VLKRVGDZSA-O 50367299 CHEMBL3392190::CHEMBL554630 Cathepsin D Bos taurus 107 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50367299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50367299&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725213 160846401 CHEMBL3392190CHEMBL554630 ZINC36295276 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747022 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C34H57N5O7/c1-20(2)16-17-35-30(42)23(7)36-27(41)19-26(40)25(18-24-14-12-11-13-15-24)37-31(43)28(21(3)4)38-32(44)29(22(5)6)39-33(45)46-34(8,9)10/h11-15,20-23,25-26,28-29,40H,16-19H2,1-10H3,(H,35,42)(H,36,41)(H,37,43)(H,38,44)(H,39,45)/t23?,25?,26-,28?,29-/m1/s1 DTDQTTSGSTUIBM-BUJYKXKISA-N 50025523 CHEMBL3392095::[1-(1-{1-Benzyl-2-hydroxy-3-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-propylcarbamoyl}-2-methyl-propylcarbamoyl)-2-methyl-propyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 95 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025523&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725171 103935397 CHEMBL3392095CHEMBL84497 ZINC36295165 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747023 COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C InChI=1S/C31H50N4O7/c1-18(2)14-23(33-30(40)28(20(5)6)35-26(37)15-19(3)4)25(36)17-27(38)32-21(7)29(39)34-24(31(41)42-8)16-22-12-10-9-11-13-22/h9-13,18-21,23-25,28,36H,14-17H2,1-8H3,(H,32,38)(H,33,40)(H,34,39)(H,35,37)/t21?,23?,24?,25-,28+/m0/s1 JNINEXBQGLJCOP-BOZJIQSSSA-N 50025521 2-(2-{3-Hydroxy-6-methyl-4-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-heptanoylamino}-propionylamino)-3-phenyl-propionic acid methyl ester::CHEMBL3392101 Cathepsin D Bos taurus 23 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025521&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725176 103935395 CHEMBL3392101CHEMBL85535 ZINC36295288 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747025 CCC(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(=O)NCCC(C)C InChI=1S/C27H52N4O5/c1-10-20(11-2)26(35)31-24(18(7)8)27(36)30-21(14-17(5)6)22(32)15-23(33)29-19(9)25(34)28-13-12-16(3)4/h16-22,24,32H,10-15H2,1-9H3,(H,28,34)(H,29,33)(H,30,36)(H,31,35)/t19?,21?,22-,24+/m0/s1 HFNUOOUZQYGIIA-ZQRRJYLRSA-N 50025525 4-[2-(2-Ethyl-butyrylamino)-3-methyl-butyrylamino]-3-hydroxy-6-methyl-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::BDBM50028394::CHEMBL262137 Cathepsin D Bos taurus 230 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025525&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44379004 103935399 CHEMBL262137CHEMBL85687 ZINC26573164 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747027 COC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C InChI=1S/C22H41N3O6/c1-12(2)9-16(17(26)11-19(28)23-15(7)22(30)31-8)24-21(29)20(14(5)6)25-18(27)10-13(3)4/h12-17,20,26H,9-11H2,1-8H3,(H,23,28)(H,24,29)(H,25,27)/t15?,16?,17-,20+/m0/s1 IXBBSGVZUPOAKN-QCECMTGHSA-N 50025527 2-{3-Hydroxy-6-methyl-4-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-heptanoylamino}-propionic acid methyl ester::CHEMBL3392103 Cathepsin D Bos taurus 1800 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025527&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725178 103935401 CHEMBL3392103CHEMBL84613 ZINC26569961 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747030 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C31H59N5O6/c1-17(2)12-13-32-29(40)22(11)33-26(39)16-24(37)23(14-18(3)4)34-30(41)28(21(9)10)36-31(42)27(20(7)8)35-25(38)15-19(5)6/h17-24,27-28,37H,12-16H2,1-11H3,(H,32,40)(H,33,39)(H,34,41)(H,35,38)(H,36,42)/t22?,23?,24-,27-,28?/m1/s1 JTZSUTRATHTTMW-GNAPXWCESA-N 50025533 3-Hydroxy-6-methyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL164635 Cathepsin D Bos taurus 3.7 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025533 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025533&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44378925 103935407 CHEMBL164635CHEMBL85944 ZINC36295272 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747031 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C InChI=1S/C25H48N4O6/c1-14(2)10-11-26-23(32)18(9)27-21(31)13-20(30)19(12-15(3)4)28-24(33)22(16(5)6)29-25(34)35-17(7)8/h14-20,22,30H,10-13H2,1-9H3,(H,26,32)(H,27,31)(H,28,33)(H,29,34)/t18?,19?,20-,22+/m0/s1 OUWLUUSDBBECSH-PEVXEQIPSA-N 50025530 BDBM50028390::CHEMBL166522::[1-(1-{1-Hydroxy-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-3-methyl-butylcarbamoyl)-2-methyl-propyl]-carbamic acid isopropyl ester Cathepsin D Bos taurus 620 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025530&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44379147 103935404 CHEMBL166522CHEMBL419481 ZINC26507036 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747032 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C34H57N5O7/c1-20(2)16-17-35-30(42)23(7)36-27(41)19-26(40)25(18-24-14-12-11-13-15-24)37-31(43)28(21(3)4)38-32(44)29(22(5)6)39-33(45)46-34(8,9)10/h11-15,20-23,25-26,28-29,40H,16-19H2,1-10H3,(H,35,42)(H,36,41)(H,37,43)(H,38,44)(H,39,45)/t23?,25?,26-,28?,29+/m0/s1 DTDQTTSGSTUIBM-ROUARABJSA-N 50025531 CHEMBL3392096::[1-(1-{1-Benzyl-2-hydroxy-3-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-propylcarbamoyl}-2-methyl-propylcarbamoyl)-2-methyl-propyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 2.1 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025531 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025531&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725172 103935405 CHEMBL3392096CHEMBL311504 ZINC36295181 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747034 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C InChI=1S/C55H79N7O11/c1-33(2)27-40(45(63)32-46(64)57-41(29-37-21-15-12-16-22-37)51(68)62-47(35(5)6)52(69)60-44(28-34(3)4)53(70)72-11)58-48(65)36(7)56-49(66)42(30-38-23-17-13-18-24-38)59-50(67)43(31-39-25-19-14-20-26-39)61-54(71)73-55(8,9)10/h12-26,33-36,40-45,47,63H,27-32H2,1-11H3,(H,56,66)(H,57,64)(H,58,65)(H,59,67)(H,60,69)(H,61,71)(H,62,68) YPBVHULVAIIHPQ-UHFFFAOYSA-N 50025515 2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-3-phenyl-propionylamino]-propionylamino}-3-hydroxy-6-methyl-heptanoylamino)-3-phenyl-propionylamino]-3-methyl-butyrylamino}-4-methyl-pentanoic acid methyl ester::CHEMBL3142513 Cathepsin D Bos taurus 12 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025515 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025515&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663019 103935389 CHEMBL3142513CHEMBL262668 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747035 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C InChI=1S/C49H75N7O11/c1-28(2)23-35(53-43(60)32(8)50-42(59)31(7)51-44(61)37(26-34-21-17-14-18-22-34)55-48(65)67-49(9,10)11)39(57)27-40(58)52-36(25-33-19-15-13-16-20-33)45(62)56-41(30(5)6)46(63)54-38(24-29(3)4)47(64)66-12/h13-22,28-32,35-39,41,57H,23-27H2,1-12H3,(H,50,59)(H,51,61)(H,52,58)(H,53,60)(H,54,63)(H,55,65)(H,56,62) MASZJCILKRUUAU-UHFFFAOYSA-N 50025510 2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-propionylamino]-propionylamino}-3-hydroxy-6-methyl-heptanoylamino)-3-phenyl-propionylamino]-3-methyl-butyrylamino}-4-methyl-pentanoic acid methyl ester::CHEMBL3142507 Cathepsin D Bos taurus 60 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025510&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663013 103935384 CHEMBL3142507CHEMBL262375 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747036 CCC(CC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(=O)NCCC(C)C InChI=1S/C26H50N4O5/c1-10-18(8)24(33)30-23(17(6)7)26(35)29-20(13-16(4)5)21(31)14-22(32)28-19(9)25(34)27-12-11-15(2)3/h15-21,23,31H,10-14H2,1-9H3,(H,27,34)(H,28,32)(H,29,35)(H,30,33)/t18?,19?,20?,21-,23+/m0/s1 UKUNJMCKBATEQU-KITTYXGWSA-N 50025532 3-Hydroxy-6-methyl-4-[3-methyl-2-(2-methyl-butyrylamino)-butyrylamino]-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::BDBM50028391::CHEMBL165448 Cathepsin D Bos taurus 120 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025532&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44378990 103935406 CHEMBL165448CHEMBL421146 ZINC26505189 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747038 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C32H61N5O5/c1-18(2)13-14-33-30(40)24(12)34-27(39)17-23(11)25(15-19(3)4)35-31(41)29(22(9)10)37-32(42)28(21(7)8)36-26(38)16-20(5)6/h18-25,28-29H,13-17H2,1-12H3,(H,33,40)(H,34,39)(H,35,41)(H,36,38)(H,37,42)/t23-,24?,25?,28+,29?/m0/s1 VBROOHAYFVCWQQ-GRBKXTSRSA-N 50025537 3,6-Dimethyl-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3392089 Cathepsin D Bos taurus 214 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025537 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025537&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725165 103935411 CHEMBL3392089CHEMBL314784 ZINC36295213 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747040 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C InChI=1S/C30H50N4O5/c1-19(2)15-16-31-27(36)22(6)32-25(35)17-21(5)24(18-23-13-11-10-12-14-23)33-28(37)26(20(3)4)34-29(38)39-30(7,8)9/h10-14,19-22,24,26H,15-18H2,1-9H3,(H,31,36)(H,32,35)(H,33,37)(H,34,38)/t21-,22?,24?,26-/m1/s1 WCNDFBSZABDLKV-VMITXTRHSA-N 50025536 (1-{1-Benzyl-2-methyl-3-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-propylcarbamoyl}-2-methyl-propyl)-carbamic acid tert-butyl ester::CHEMBL3392092 Cathepsin D Bos taurus 930 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025536&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725168 103935410 CHEMBL3392092CHEMBL86251 ZINC26573309 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747042 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C32H61N5O6/c1-18(2)14-15-33-28(39)23(10)34-25(38)17-22(9)24(16-19(3)4)35-29(40)26(20(5)6)36-30(41)27(21(7)8)37-31(42)43-32(11,12)13/h18-24,26-27H,14-17H2,1-13H3,(H,33,39)(H,34,38)(H,35,40)(H,36,41)(H,37,42)/t22-,23?,24?,26?,27-/m1/s1 XHAGYXYLFCHAMX-JEQIRWFESA-N 50025539 CHEMBL3392082::{2-Methyl-1-[2-methyl-1-(3-methyl-1-{1-methyl-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-butylcarbamoyl)-propylcarbamoyl]-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 47 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025539 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025539&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725158 103935413 CHEMBL3392082CHEMBL316414 ZINC36295256 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747043 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C35H59N5O6/c1-21(2)17-18-36-31(42)25(8)37-28(41)19-24(7)27(20-26-15-13-12-14-16-26)38-32(43)29(22(3)4)39-33(44)30(23(5)6)40-34(45)46-35(9,10)11/h12-16,21-25,27,29-30H,17-20H2,1-11H3,(H,36,42)(H,37,41)(H,38,43)(H,39,44)(H,40,45)/t24-,25?,27?,29?,30-/m1/s1 YDGPAIMBSACIBH-ARUOENDNSA-N 50025535 CHEMBL3392093::[1-(1-{1-Benzyl-2-methyl-3-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-propylcarbamoyl}-2-methyl-propylcarbamoyl)-2-methyl-propyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 12 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025535 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025535&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725169 103935409 CHEMBL3392093CHEMBL314272 ZINC36295241 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747045 COC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C InChI=1S/C28H52N4O7/c1-15(2)11-20(30-27(37)25(18(7)8)32-23(34)13-17(5)6)22(33)14-24(35)29-19(9)26(36)31-21(12-16(3)4)28(38)39-10/h15-22,25,33H,11-14H2,1-10H3,(H,29,35)(H,30,37)(H,31,36)(H,32,34)/t19?,20?,21?,22-,25+/m0/s1 PUVUKKVXAWYCGE-HWOQLGNESA-N 50025534 2-(2-{3-Hydroxy-6-methyl-4-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-heptanoylamino}-propionylamino)-4-methyl-pentanoic acid methyl ester::CHEMBL3392102 Cathepsin D Bos taurus 43 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025534 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025534&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725177 103935408 CHEMBL3392102CHEMBL82961 ZINC36295293 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747047 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C34H57N5O6/c1-20(2)15-16-35-32(43)24(9)36-29(42)19-27(40)26(18-25-13-11-10-12-14-25)37-33(44)31(23(7)8)39-34(45)30(22(5)6)38-28(41)17-21(3)4/h10-14,20-24,26-27,30-31,40H,15-19H2,1-9H3,(H,35,43)(H,36,42)(H,37,44)(H,38,41)(H,39,45)/t24?,26?,27-,30-,31?/m1/s1 DSUDGIUWJOYCMK-AFNKLIEYSA-N 50025542 3-Hydroxy-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-5-phenyl-pentanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3392098 Cathepsin D Bos taurus 1 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025542 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025542&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725174 103935416 CHEMBL3392098CHEMBL408554 ZINC36295189 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747050 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C InChI=1S/C36H60N6O8/c1-21(2)16-17-37-31(45)23(5)38-30(44)20-29(43)27(18-22(3)4)41-33(47)25(7)39-32(46)24(6)40-34(48)28(19-26-14-12-11-13-15-26)42-35(49)50-36(8,9)10/h11-15,21-25,27-29,43H,16-20H2,1-10H3,(H,37,45)(H,38,44)(H,39,46)(H,40,48)(H,41,47)(H,42,49) ZUGYUBYRAGBOBC-UHFFFAOYSA-N 50025526 (1-{1-[1-(1-{1-Hydroxy-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL3142509 Cathepsin D Bos taurus 100 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025526&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663015 103935400 CHEMBL3142509CHEMBL85836 ZINC26569361 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747051 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C InChI=1S/C26H50N4O5/c1-15(2)10-11-27-25(34)19(9)28-23(33)14-21(31)20(12-16(3)4)29-26(35)24(18(7)8)30-22(32)13-17(5)6/h15-21,24,31H,10-14H2,1-9H3,(H,27,34)(H,28,33)(H,29,35)(H,30,32)/t19-,20-,21-,24-/m0/s1 JQOFUZAKCVQZTH-CIEVZJJWSA-N 50017485 1N-[1-isopentylcarbamoyl-(1S)-ethyl]-4-[1-(1-amino-1-methylpropylcarboxamido)-2-methyl-(1S)-propylcarboxamido]-3-hydroxy-6-methyl-(3S,4S)-heptanamide::3-Hydroxy-6-methyl-4-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-heptanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL28738 Cathepsin D Bos taurus 220 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017485 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017485&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278232 103928753 CHEMBL28738 ZINC27307441 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747052 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C31H59N5O7/c1-17(2)13-14-32-27(39)21(9)33-24(38)16-23(37)22(15-18(3)4)34-28(40)25(19(5)6)35-29(41)26(20(7)8)36-30(42)43-31(10,11)12/h17-23,25-26,37H,13-16H2,1-12H3,(H,32,39)(H,33,38)(H,34,40)(H,35,41)(H,36,42)/t21?,22?,23-,25?,26-/m1/s1 GQYQVRLKCQSBAG-XULWKCEQSA-N 50025511 CHEMBL164716::{1-[1-(1-{1-Hydroxy-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-3-methyl-butylcarbamoyl)-2-methyl-propylcarbamoyl]-2-methyl-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 1.1 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025511&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44378838 103935385 CHEMBL164716CHEMBL86225 ZINC36295205 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747054 COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C InChI=1S/C43H72N6O10/c1-24(2)19-30(34(50)23-35(51)49-36(27(7)8)40(55)47-33(21-26(5)6)41(56)58-13)45-39(54)31(20-25(3)4)46-37(52)28(9)44-38(53)32(22-29-17-15-14-16-18-29)48-42(57)59-43(10,11)12/h14-18,24-28,30-34,36,50H,19-23H2,1-13H3,(H,44,53)(H,45,54)(H,46,52)(H,47,55)(H,48,57)(H,49,51) XGOFEAGVTCKQCQ-UHFFFAOYSA-N 50025528 2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-propionylamino]-4-methyl-pentanoylamino}-3-hydroxy-6-methyl-heptanoylamino)-3-methyl-butyrylamino]-4-methyl-pentanoic acid methyl ester::CHEMBL3142508 Cathepsin D Bos taurus 1.1 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025528&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 90663014 103935402 CHEMBL3142508CHEMBL85625 ZINC95544650 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747055 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C InChI=1S/C29H48N4O5/c1-18(2)13-14-30-28(37)21(7)31-26(36)17-24(34)23(16-22-11-9-8-10-12-22)32-29(38)27(20(5)6)33-25(35)15-19(3)4/h8-12,18-21,23-24,27,34H,13-17H2,1-7H3,(H,30,37)(H,31,36)(H,32,38)(H,33,35)/t21-,23+,24-,27+/m0/s1 WCSGYAARMZFPGM-WCJVPVSSSA-N 50025524 3-Hydroxy-4-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-5-phenyl-pentanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3037816 Cathepsin D Bos taurus 52 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025524&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 73357295 103935398 CHEMBL3037816 ZINC26509119 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50747056 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C34H57N5O6/c1-20(2)15-16-35-32(43)24(9)36-29(42)19-27(40)26(18-25-13-11-10-12-14-25)37-33(44)31(23(7)8)39-34(45)30(22(5)6)38-28(41)17-21(3)4/h10-14,20-24,26-27,30-31,40H,15-19H2,1-9H3,(H,35,43)(H,36,42)(H,37,44)(H,38,41)(H,39,45)/t24?,26?,27-,30+,31?/m0/s1 DSUDGIUWJOYCMK-CXJZZPSHSA-N 50025541 3-Hydroxy-4-{3-methyl-2-[3-methyl-2-(3-methyl-butyrylamino)-butyrylamino]-butyrylamino}-5-phenyl-pentanoic acid [1-(3-methyl-butylcarbamoyl)-ethyl]-amide::CHEMBL3392097 Cathepsin D Bos taurus 100 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025541 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025541&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725173 103935415 CHEMBL3392097CHEMBL83600 ZINC36295173 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757050 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)CCC[N+](C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C42H67N9O6/c1-7-28(2)39(42(57)46-27-32-26-45-29(3)47-40(32)43)50-38(55)25-35(52)33(23-30-15-10-8-11-16-30)48-37(54)20-21-44-41(56)34(24-31-17-12-9-13-18-31)49-36(53)19-14-22-51(4,5)6/h9,12-13,17-18,26,28,30,33-35,39,52H,7-8,10-11,14-16,19-25,27H2,1-6H3,(H6-,43,44,45,46,47,48,49,50,53,54,55,56,57)/p+1/t28-,33-,34-,35-,39-/m0/s1 KWOAFAXXAHMPCT-KVJDXRNMSA-O 50010406 CHEMBL325329::[4-(trimethylammonio)butyryl]-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amidechloride:hydrochloride.; hydrochloride Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010406&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109760 103923220 CHEMBL325329 ZINC95539936 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757052 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CS(=O)(=O)CC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H61N7O9S/c1-7-25(2)36(38(52)43-22-29-21-42-26(3)44-37(29)41)47-34(50)20-32(48)30(18-27-14-10-8-11-15-27)45-35(51)24-57(54,55)23-33(49)31(19-28-16-12-9-13-17-28)46-39(53)56-40(4,5)6/h9,12-13,16-17,21,25,27,30-32,36,48H,7-8,10-11,14-15,18-20,22-24H2,1-6H3,(H,43,52)(H,45,51)(H,46,53)(H,47,50)(H2,41,42,44)/t25-,30-,31-,32-,36-/m0/s1 HCHGOFLDYWGIJR-PMKJXMQSSA-N 50010407 CHEMBL109871::{3-[(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-methanesulfonyl]-1-benzyl-2-oxo-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010407&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109735 103923221 CHEMBL109871 ZINC95546293 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757053 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCC(N)CC1)C(=O)NCc1cnc(C)nc1N InChI=1S/C41H64N10O6/c1-4-26(2)37(40(56)46-25-30-24-45-27(3)47-38(30)43)50-36(54)23-34(52)32(21-28-11-7-5-8-12-28)48-35(53)15-18-44-39(55)33(22-29-13-9-6-10-14-29)49-41(57)51-19-16-31(42)17-20-51/h6,9-10,13-14,24,26,28,31-34,37,52H,4-5,7-8,11-12,15-23,25,42H2,1-3H3,(H,44,55)(H,46,56)(H,48,53)(H,49,57)(H,50,54)(H2,43,45,47)/t26-,32-,33-,34-,37-/m0/s1 HZSPXNCSLJOMIF-NQKKVWJDSA-N 50010408 4-Amino-piperidine-1-carboxylic acid {1-[2-(3-{1-[(4-amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethyl}-amide: dihydrochloride::CHEMBL540047 Cathepsin D Bos taurus 8500 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010408&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 0GQ 1E80 9833018 103923222 CHEMBL540047 ZINC95539825 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757055 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCC(CC1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C46H72N10O8/c1-7-29(2)40(43(61)50-28-33-27-49-30(3)51-41(33)47)55-39(59)26-37(57)35(24-31-14-10-8-11-15-31)53-38(58)18-21-48-42(60)36(25-32-16-12-9-13-17-32)54-44(62)56-22-19-34(20-23-56)52-45(63)64-46(4,5)6/h9,12-13,16-17,27,29,31,34-37,40,57H,7-8,10-11,14-15,18-26,28H2,1-6H3,(H,48,60)(H,50,61)(H,52,63)(H,53,58)(H,54,62)(H,55,59)(H2,47,49,51)/t29-,35-,36-,37-,40-/m0/s1 SRTQIVBOFPIILO-XWLYGYOUSA-N 50010415 (1-{1-[2-(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-piperidin-4-yl)-carbamic acid tert-butyl ester::CHEMBL407882 Cathepsin D Bos taurus 5900 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010415 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010415&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15924453 103923229 CHEMBL407882 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757056 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CCCN(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C42H67N9O6/c1-7-27(2)38(42(57)46-26-32-25-44-29(4)47-39(32)43)50-37(54)23-35(52)33(21-30-15-10-8-11-16-30)49-40(55)28(3)24-45-41(56)34(22-31-17-12-9-13-18-31)48-36(53)19-14-20-51(5)6/h9,12-13,17-18,25,27-28,30,33-35,38,52H,7-8,10-11,14-16,19-24,26H2,1-6H3,(H,45,56)(H,46,57)(H,48,53)(H,49,55)(H,50,54)(H2,43,44,47)/t27-,28+,33-,34-,35-,38-/m0/s1 BNRQBPANZZOZHA-OMUMOAHXSA-N 50368155 CHEMBL1203094 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368155&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44339873 160847257 CHEMBL1203094 ZINC95546474 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757057 CCOC(=O)C1CCN(CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)N[C@@H]([C@@H](C)CC)C(=O)NCc1cnc(C)nc1N InChI=1S/C44H67N9O8/c1-5-28(3)39(42(58)48-27-33-26-47-29(4)49-40(33)45)52-38(56)25-36(54)34(23-30-13-9-7-10-14-30)50-37(55)17-20-46-41(57)35(24-31-15-11-8-12-16-31)51-44(60)53-21-18-32(19-22-53)43(59)61-6-2/h8,11-12,15-16,26,28,30,32,34-36,39,54H,5-7,9-10,13-14,17-25,27H2,1-4H3,(H,46,57)(H,48,58)(H,50,55)(H,51,60)(H,52,56)(H2,45,47,49)/t28-,34-,35-,36-,39-/m0/s1 OJSJJFYMVWKMPG-KUCMJJRQSA-N 50010416 CHEMBL324692::[[4-(Ethoxycarbonyl)piperdino]carbonyl]-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide Cathepsin D Bos taurus 3150 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010416&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109764 103923230 CHEMBL324692 ZINC95610793 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757062 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)CC(C)(C)N)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H63N9O6/c1-6-25(2)36(39(55)45-24-29-23-44-26(3)46-37(29)41)49-34(52)21-32(50)30(19-27-13-9-7-10-14-27)47-33(51)17-18-43-38(54)31(20-28-15-11-8-12-16-28)48-35(53)22-40(4,5)42/h8,11-12,15-16,23,25,27,30-32,36,50H,6-7,9-10,13-14,17-22,24,42H2,1-5H3,(H,43,54)(H,45,55)(H,47,51)(H,48,53)(H,49,52)(H2,41,44,46)/t25-,30-,31+,32-,36-/m0/s1 FNYXLVDAMGHCMH-RGXDSYRCSA-N 50368156 CHEMBL1203096 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368156&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44339874 160847258 CHEMBL1203096 ZINC95610845 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757069 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H62N8O7/c1-7-25(2)35(38(53)44-24-29-23-43-26(3)45-36(29)41)48-34(51)22-32(49)30(20-27-14-10-8-11-15-27)46-33(50)18-19-42-37(52)31(21-28-16-12-9-13-17-28)47-39(54)55-40(4,5)6/h9,12-13,16-17,23,25,27,30-32,35,49H,7-8,10-11,14-15,18-22,24H2,1-6H3,(H,42,52)(H,44,53)(H,46,50)(H,47,54)(H,48,51)(H2,41,43,45)/t25-,30+,31+,32-,35-/m0/s1 SESZAKWYMGICMQ-KPTLYYJKSA-N 50010421 BOC-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL110060 Cathepsin D Bos taurus 7900 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010421&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44340211 103923235 CHEMBL110060 ZINC95546296 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757076 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CSCC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H61N7O7S/c1-7-25(2)36(38(52)43-22-29-21-42-26(3)44-37(29)41)47-34(50)20-32(48)30(18-27-14-10-8-11-15-27)45-35(51)24-55-23-33(49)31(19-28-16-12-9-13-17-28)46-39(53)54-40(4,5)6/h9,12-13,16-17,21,25,27,30-32,36,48H,7-8,10-11,14-15,18-20,22-24H2,1-6H3,(H,43,52)(H,45,51)(H,46,53)(H,47,50)(H2,41,42,44)/t25-,30-,31-,32-,36-/m0/s1 LBVJFOCCJXTDLM-PMKJXMQSSA-N 50010426 CHEMBL324588::{3-[(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-methylsulfanyl]-1-benzyl-2-oxo-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 28000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010426&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14301580 103923240 CHEMBL324588 ZINC95610788 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757082 CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)CCC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C41H65N7O7/c1-11-26(6)36(39(53)44-23-29-22-43-27(7)45-37(29)42)48-38(52)30(25(4)5)21-34(50)31(19-24(2)3)46-35(51)18-17-33(49)32(20-28-15-13-12-14-16-28)47-40(54)55-41(8,9)10/h12-16,22,24-26,30-32,34,36,50H,11,17-21,23H2,1-10H3,(H,44,53)(H,46,51)(H,47,54)(H,48,52)(H2,42,43,45)/t26-,30-,31-,32-,34-,36-/m0/s1 SGNIGQPRTHODHG-DIHQDUKCSA-N 50010428 BOC-Phe-psi[COCH2]Gly-Leu-psi-[CHOHCH2]Val-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL112778 Cathepsin D Bos taurus 8000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010428 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010428&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109753 103923242 CHEMBL112778 ZINC95546471 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757087 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H63N7O7/c1-7-25(2)36(38(52)43-24-29-23-42-26(3)44-37(29)41)47-35(51)22-33(49)31(21-28-16-12-9-13-17-28)45-34(50)19-18-32(48)30(20-27-14-10-8-11-15-27)46-39(53)54-40(4,5)6/h8,10-11,14-15,23,25,28,30-33,36,48-49H,7,9,12-13,16-22,24H2,1-6H3,(H,43,52)(H,45,50)(H,46,53)(H,47,51)(H2,41,42,44)/t25-,30-,31-,32-,33-,36-/m0/s1 IJCHNOXSWVSDOP-WITQEOTBSA-N 50010413 CHEMBL324624::[4-(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-1-benzyl-2-hydroxy-butyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010413&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14301589 103923227 CHEMBL324624 ZINC03924581 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757090 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCC(CC1)N(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C43H68N10O6/c1-6-28(2)39(42(58)47-27-32-26-46-29(3)48-40(32)44)51-38(56)25-36(54)34(23-30-13-9-7-10-14-30)49-37(55)17-20-45-41(57)35(24-31-15-11-8-12-16-31)50-43(59)53-21-18-33(19-22-53)52(4)5/h8,11-12,15-16,26,28,30,33-36,39,54H,6-7,9-10,13-14,17-25,27H2,1-5H3,(H,45,57)(H,47,58)(H,49,55)(H,50,59)(H,51,56)(H2,44,46,48)/t28-,34-,35-,36-,39-/m0/s1 LQEGZASPPAQUNS-KUCMJJRQSA-N 50010419 4-Dimethylamino-piperidine-1-carboxylic acid {1-[2-(3-{1-[(4-amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethyl}-amide::CHEMBL111144 Cathepsin D Bos taurus 10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010419&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109767 103923233 CHEMBL111144 ZINC95546308 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757094 CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C41H66N8O7/c1-11-26(6)35(39(54)45-23-29-22-44-27(7)46-36(29)42)49-37(52)30(25(4)5)21-33(50)31(19-24(2)3)47-34(51)17-18-43-38(53)32(20-28-15-13-12-14-16-28)48-40(55)56-41(8,9)10/h12-16,22,24-26,30-33,35,50H,11,17-21,23H2,1-10H3,(H,43,53)(H,45,54)(H,47,51)(H,48,55)(H,49,52)(H2,42,44,46)/t26-,30-,31-,32-,33-,35-/m0/s1 OWXQDSNBNKFMJU-QTCSXKEMSA-N 50010417 BOC-Phe-beta-Ala-Leu-psi[CHOHCH2]Val-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL111515 Cathepsin D Bos taurus 4700 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010417 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010417&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109752 103923231 CHEMBL111515 ZINC95546312 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757095 CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H64N8O7/c1-11-25(6)34(38(53)43-21-28-20-42-26(7)45-35(28)41)48-36(51)29(24(4)5)19-32(49)30(17-23(2)3)46-33(50)22-44-37(52)31(18-27-15-13-12-14-16-27)47-39(54)55-40(8,9)10/h12-16,20,23-25,29-32,34,49H,11,17-19,21-22H2,1-10H3,(H,43,53)(H,44,52)(H,46,50)(H,47,54)(H,48,51)(H2,41,42,45)/t25-,29-,30-,31-,32-,34-/m0/s1 HQWUNRFDHMRGJE-DHWQJOKWSA-N 50010425 BOC-Phe-Gly-Leu-psi[CHOHCH2]Gly-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL109429 Cathepsin D Bos taurus 3900 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010425 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010425&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109751 103923239 CHEMBL109429 ZINC95546275 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757101 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@@H](CC1CCCCC1)NC(=O)CCCNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C41H64N8O7/c1-7-26(2)36(39(54)45-25-30-24-44-27(3)46-37(30)42)49-35(52)23-33(50)31(21-28-15-10-8-11-16-28)47-34(51)19-14-20-43-38(53)32(22-29-17-12-9-13-18-29)48-40(55)56-41(4,5)6/h9,12-13,17-18,24,26,28,31-33,36,50H,7-8,10-11,14-16,19-23,25H2,1-6H3,(H,43,53)(H,45,54)(H,47,51)(H,48,55)(H,49,52)(H2,42,44,46)/t26-,31+,32+,33-,36-/m0/s1 UFAAJRSWFBNGLP-XMQIUFLTSA-N 50010430 BOC-Phe-N-(CH2)3CO-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL14672 Cathepsin D Bos taurus 3200 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010430 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010430&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44340179 103923244 CHEMBL14672 ZINC95606247 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757103 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H63N7O7/c1-7-25(2)36(38(52)43-24-29-23-42-26(3)44-37(29)41)47-35(51)22-33(49)31(21-28-16-12-9-13-17-28)45-34(50)19-18-32(48)30(20-27-14-10-8-11-15-27)46-39(53)54-40(4,5)6/h8,10-11,14-15,23,25,28,30-33,36,48-49H,7,9,12-13,16-22,24H2,1-6H3,(H,43,52)(H,45,50)(H,46,53)(H,47,51)(H2,41,42,44)/t25-,30-,31-,32+,33-,36-/m0/s1 IJCHNOXSWVSDOP-IRODVYFGSA-N 50010410 CHEMBL323006::[4-(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-1-benzyl-2-hydroxy-butyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010410&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44339967 103923224 CHEMBL323006 ZINC26960091 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757105 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCc1cnc(C)nc1N InChI=1S/C35H54N8O5/c1-4-22(2)32(35(48)40-21-26-20-39-23(3)41-33(26)37)43-31(46)19-29(44)28(18-25-13-9-6-10-14-25)42-30(45)15-16-38-34(47)27(36)17-24-11-7-5-8-12-24/h5,7-8,11-12,20,22,25,27-29,32,44H,4,6,9-10,13-19,21,36H2,1-3H3,(H,38,47)(H,40,48)(H,42,45)(H,43,46)(H2,37,39,41)/t22-,27-,28-,29-,32-/m0/s1 OJUXFOTVKMYAOQ-MMTDUKOKSA-N 50010422 CHEMBL545512::H-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide; dihydrochloride Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010422&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109755 103923236 CHEMBL545512 ZINC26985902 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757106 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cccnc1 InChI=1S/C43H56N8O7/c1-6-28(2)38(41(56)46-25-31-18-13-19-44-24-31)51-37(53)23-36(52)33(20-29-14-9-7-10-15-29)48-40(55)35(22-32-26-45-27-47-32)49-39(54)34(21-30-16-11-8-12-17-30)50-42(57)58-43(3,4)5/h7-19,24,26-28,33-36,38,52H,6,20-23,25H2,1-5H3,(H,45,47)(H,46,56)(H,48,55)(H,49,54)(H,50,57)(H,51,53)/t28-,33-,34-,35-,36-,38-/m0/s1 XOZNZPCYPMTOJI-BQKJCZQMSA-N 50010429 CHEMBL323967::{1-[1-(1-Cyclohexylmethyl-2-hydroxy-3-{2-methyl-1-[(pyridin-3-ylmethyl)-carbamoyl]-butylcarbamoyl}-propylcarbamoyl)-2-(3H-imidazol-4-yl)-ethylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 5800 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010429 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010429&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44340210 103923243 CHEMBL323967 ZINC95610832 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757107 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CSC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H63N7O7S/c1-7-25(2)36(38(52)43-22-29-21-42-26(3)44-37(29)41)47-34(50)20-32(48)30(18-27-14-10-8-11-15-27)45-35(51)24-55-23-33(49)31(19-28-16-12-9-13-17-28)46-39(53)54-40(4,5)6/h9,12-13,16-17,21,25,27,30-33,36,48-49H,7-8,10-11,14-15,18-20,22-24H2,1-6H3,(H,43,52)(H,45,51)(H,46,53)(H,47,50)(H2,41,42,44)/t25-,30-,31-,32-,33-,36-/m0/s1 GHOSSUACYAUAKQ-WITQEOTBSA-N 50010405 CHEMBL113593::{3-[(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-methylsulfanyl]-1-benzyl-2-hydroxy-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus >100000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010405 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010405&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14301583 103923219 CHEMBL113593 ZINC95546487 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757108 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@@H](CC1CCCCC1)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C39H60N8O7/c1-7-24(2)34(37(52)42-22-28-21-41-25(3)44-35(28)40)47-32(49)20-31(48)29(18-26-14-10-8-11-15-26)45-33(50)23-43-36(51)30(19-27-16-12-9-13-17-27)46-38(53)54-39(4,5)6/h9,12-13,16-17,21,24,26,29-31,34,48H,7-8,10-11,14-15,18-20,22-23H2,1-6H3,(H,42,52)(H,43,51)(H,45,50)(H,46,53)(H,47,49)(H2,40,41,44)/t24-,29+,30+,31-,34-/m0/s1 MFAFAEJTFBGXMU-SJWYQIPUSA-N 50010427 BOC-Phe-Gly-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL109768 Cathepsin D Bos taurus 13000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010427 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010427&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44339906 103923241 CHEMBL109768 ZINC26975158 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758958 OC([C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)c1csc(NC(=O)OCc2ccccc2)n1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C43H58F2N8O10S2/c44-43(45,40(57)46-16-17-52-18-22-61-23-19-52)37(54)33(26-30-10-4-1-5-11-30)47-39(56)36(35-29-64-41(48-35)50-42(58)63-28-32-14-8-3-9-15-32)49-38(55)34(27-31-12-6-2-7-13-31)51-65(59,60)53-20-24-62-25-21-53/h2-3,6-9,12-15,29-30,33-34,36-37,51,54H,1,4-5,10-11,16-28H2,(H,46,57)(H,47,56)(H,49,55)(H,48,50,58)/t33-,34-,36-,37?/m0/s1 ZDLVIZHUELHGBX-MOENERJOSA-N 50008120 (4-{[1-Cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propylcarbamoyl]-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-methyl}-thiazol-2-yl)-carbamic acid benzyl ester::CHEMBL285884 Cathepsin D Bos taurus 16940 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008120&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278603 103921333 CHEMBL285884 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758959 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@@H](NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C1CCCCC1 InChI=1S/C34H50F2N6O8S/c1-2-9-27(38-32(45)28(24-25-10-5-3-6-11-25)40-51(47,48)42-18-22-50-23-19-42)31(44)39-29(26-12-7-4-8-13-26)30(43)34(35,36)33(46)37-14-15-41-16-20-49-21-17-41/h2-3,5-6,10-11,26-29,40H,1,4,7-9,12-24H2,(H,37,46)(H,38,45)(H,39,44)/t27-,28-,29-/m0/s1 FOXHTNDMZGBSAX-AWCRTANDSA-N 50008121 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide; Hydrate::CHEMBL31259 Cathepsin D Bos taurus 761 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008121&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126561 103921334 CHEMBL31259 ZINC29203131 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758962 CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1 InChI=1S/C34H52F2N6O6S/c1-4-12-27(39-32(45)29(22-26-15-10-7-11-16-26)41-49(47,48)42-19-17-37-18-20-42)31(44)40-28(21-25-13-8-6-9-14-25)30(43)34(35,36)33(46)38-23-24(3)5-2/h4,7,10-11,15-16,24-25,27-29,37,41H,1,5-6,8-9,12-14,17-23H2,2-3H3,(H,38,46)(H,39,45)(H,40,44)/t24-,27-,28-,29-/m0/s1 ZAUCFWTWRBZAIR-JSRHHAARSA-N 50008127 2-[3-Phenyl-2-(piperazine-1-sulfonylamino)-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-methyl-butylcarbamoyl)-2-oxo-propyl]-amide; Hydrate::CHEMBL285095 Cathepsin D Bos taurus 47 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008127&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126582 103921340 CHEMBL285095 ZINC28772031 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758973 CCCO[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H54F2N6O9S/c1-2-19-52-33(40-31(45)29(25-27-11-7-4-8-12-27)41-53(48,49)43-17-22-51-23-18-43)32(46)39-28(24-26-9-5-3-6-10-26)30(44)35(36,37)34(47)38-13-14-42-15-20-50-21-16-42/h4,7-8,11-12,26,28-29,33,41H,2-3,5-6,9-10,13-25H2,1H3,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,33-/m0/s1 QUSCBNSWNRTFJQ-DWDWHFOYSA-N 50008134 5-Cyclohexyl-2,2-difluoro-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-2-propoxy-acetylamino}-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; Hydrate::CHEMBL28132 Cathepsin D Bos taurus 237 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008134&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278672 103921347 CHEMBL28132 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758974 CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H55F2N5O7/c1-5-12-27(40-32(46)29(24-26-15-10-7-11-16-26)42-34(48)50-35(2,3)4)31(45)41-28(23-25-13-8-6-9-14-25)30(44)36(37,38)33(47)39-17-18-43-19-21-49-22-20-43/h5,7,10-11,15-16,25,27-30,44H,1,6,8-9,12-14,17-24H2,2-4H3,(H,39,47)(H,40,46)(H,41,45)(H,42,48)/t27-,28-,29-,30?/m0/s1 JLENQMDKYKTRLR-UNVCSADESA-N 50008135 (1-{1-[1-Cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propylcarbamoyl]-but-3-enylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL285778 Cathepsin D Bos taurus 18820 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008135&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44279044 103921348 CHEMBL285778 ZINC29207606 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758975 CN1CCN(CC1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H57F2N7O7S/c1-3-10-29(40-34(48)31(26-28-13-8-5-9-14-28)42-53(50,51)45-19-17-43(2)18-20-45)33(47)41-30(25-27-11-6-4-7-12-27)32(46)36(37,38)35(49)39-15-16-44-21-23-52-24-22-44/h3,5,8-9,13-14,27,29-32,42,46H,1,4,6-7,10-12,15-26H2,2H3,(H,39,49)(H,40,48)(H,41,47)/t29-,30-,31-,32?/m0/s1 PRGFSIVIFNFQPE-WDJCGXDUSA-N 50008137 2-[2-(4-Methyl-piperazine-1-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; Hydrate::CHEMBL405764 Cathepsin D Bos taurus 25300 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008137 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008137&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44279045 103921350 CHEMBL405764 ZINC95540251 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758976 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C35H46F2N6O8S/c1-2-9-28(39-33(46)30(25-27-12-7-4-8-13-27)41-52(48,49)43-18-22-51-23-19-43)32(45)40-29(24-26-10-5-3-6-11-26)31(44)35(36,37)34(47)38-14-15-42-16-20-50-21-17-42/h2-8,10-13,28-30,41H,1,9,14-25H2,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30-/m0/s1 QFXJBJPEYXTAPR-DTXPUJKBSA-N 50008136 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-benzyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide; Hydrate::CHEMBL286085 Cathepsin D Bos taurus 90 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008136&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126560 103921349 CHEMBL286085 ZINC95608748 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758978 CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H58F2N6O8S/c1-2-3-14-29(40-34(47)31(26-28-12-8-5-9-13-28)42-53(49,50)44-19-23-52-24-20-44)33(46)41-30(25-27-10-6-4-7-11-27)32(45)36(37,38)35(48)39-15-16-43-17-21-51-22-18-43/h5,8-9,12-13,27,29-32,42,45H,2-4,6-7,10-11,14-26H2,1H3,(H,39,48)(H,40,47)(H,41,46)/t29-,30-,31-,32?/m0/s1 FEPCKGBXHTYWKL-WDJCGXDUSA-N 50008138 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-hexanoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide::CHEMBL21684 Cathepsin D Bos taurus 1111 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008138 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008138&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278764 103921351 CHEMBL21684 ZINC95607104 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758979 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C35H52F2N6O8S/c1-2-9-28(39-33(46)30(25-27-12-7-4-8-13-27)41-52(48,49)43-18-22-51-23-19-43)32(45)40-29(24-26-10-5-3-6-11-26)31(44)35(36,37)34(47)38-14-15-42-16-20-50-21-17-42/h2,4,7-8,12-13,26,28-30,41H,1,3,5-6,9-11,14-25H2,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30-/m0/s1 MQDDTALXSBQTQP-DTXPUJKBSA-N 50008139 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide::2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide; Hydrate; CH3SO3H::CHEMBL287423 Cathepsin D Bos taurus 164 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008139 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008139&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10078814 103921352 CHEMBL287423 ZINC95608772 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758980 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C36H52F2N8O8S/c37-36(38,35(50)40-11-12-45-13-17-53-18-14-45)32(47)29(21-26-7-3-1-4-8-26)42-33(48)30(23-28-24-39-25-41-28)43-34(49)31(22-27-9-5-2-6-10-27)44-55(51,52)46-15-19-54-20-16-46/h2,5-6,9-10,24-26,29-31,44H,1,3-4,7-8,11-23H2,(H,39,41)(H,40,50)(H,42,48)(H,43,49)/t29-,30-,31-/m0/s1 WTKGBRNASVNILX-CHQNGUEUSA-N 50008123 5-Cyclohexyl-2,2-difluoro-4-{3-(1H-imidazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; Hydrate::CHEMBL262107 Cathepsin D Bos taurus >1000000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008123&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15018067 103921336 CHEMBL262107 ZINC95607916 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758982 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1cccnc1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C39H54F2N6O6/c1-2-10-31(45-37(51)33(26-29-13-7-4-8-14-29)44-34(48)17-16-30-15-9-18-42-27-30)36(50)46-32(25-28-11-5-3-6-12-28)35(49)39(40,41)38(52)43-19-20-47-21-23-53-24-22-47/h2,4,7-9,13-15,18,27-28,31-33,35,49H,1,3,5-6,10-12,16-17,19-26H2,(H,43,52)(H,44,48)(H,45,51)(H,46,50)/t31-,32-,33-,35?/m0/s1 MPZVHRBLHWRGCZ-OKCSSABNSA-N 50008130 2-[3-Phenyl-2-(3-pyridin-3-yl-propionylamino)-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide::CHEMBL286951 Cathepsin D Bos taurus >1000000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008130&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278918 103921343 CHEMBL286951 ZINC29203970 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758984 CNC(=S)NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C38H62F2N8O8S2/c1-41-37(57)43-15-9-8-14-30(44-35(51)32(27-29-12-6-3-7-13-29)46-58(53,54)48-20-24-56-25-21-48)34(50)45-31(26-28-10-4-2-5-11-28)33(49)38(39,40)36(52)42-16-17-47-18-22-55-23-19-47/h3,6-7,12-13,28,30-33,46,49H,2,4-5,8-11,14-27H2,1H3,(H,42,52)(H,44,51)(H,45,50)(H2,41,43,57)/t30-,31-,32-,33?/m0/s1 FYHDUDNCHVCGMS-KSTJSZMBSA-N 50008128 6-(3-Methyl-thioureido)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-hexanoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide::CHEMBL287265 Cathepsin D Bos taurus 9954 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008128&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278779 103921341 CHEMBL287265 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758986 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCc1ccccn1 InChI=1S/C36H50F2N6O7S/c1-2-11-29(41-34(47)31(25-27-14-7-4-8-15-27)43-52(49,50)44-20-22-51-23-21-44)33(46)42-30(24-26-12-5-3-6-13-26)32(45)36(37,38)35(48)40-19-17-28-16-9-10-18-39-28/h2,4,7-10,14-16,18,26,29-32,43,45H,1,3,5-6,11-13,17,19-25H2,(H,40,48)(H,41,47)(H,42,46)/t29-,30-,31-,32?/m0/s1 CCINVPALEJCQHQ-WDJCGXDUSA-N 50008141 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-pyridin-2-yl-ethylcarbamoyl)-propyl]-amide; methyl alcohol::CHEMBL31910 Cathepsin D Bos taurus 165 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008141 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008141&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278697 103921354 CHEMBL31910 ZINC95608693 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758990 CCCO[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H56F2N6O9S/c1-2-19-52-33(40-31(45)29(25-27-11-7-4-8-12-27)41-53(48,49)43-17-22-51-23-18-43)32(46)39-28(24-26-9-5-3-6-10-26)30(44)35(36,37)34(47)38-13-14-42-15-20-50-21-16-42/h4,7-8,11-12,26,28-30,33,41,44H,2-3,5-6,9-10,13-25H2,1H3,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30?,33-/m0/s1 DWJLWZMNUKFHOF-RRZOSISZSA-N 50008148 5-Cyclohexyl-2,2-difluoro-3-hydroxy-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-2-propoxy-acetylamino}-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; methyl alcohol::CHEMBL284254 Cathepsin D Bos taurus 700 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008148 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008148&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278754 103921361 CHEMBL284254 ZINC95542871 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758991 CCS[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C34H51F2N5O7S2/c1-4-12-27(38-32(44)29(22-26-15-10-7-11-16-26)40-50(46,47)41-17-19-48-20-18-41)31(43)39-28(21-25-13-8-6-9-14-25)30(42)34(35,36)33(45)37-23-24(3)49-5-2/h4,7,10-11,15-16,24-25,27-29,40H,1,5-6,8-9,12-14,17-23H2,2-3H3,(H,37,45)(H,38,44)(H,39,43)/t24-,27+,28+,29+/m1/s1 PDQJGVKVBJRGKU-KHUDPXOFSA-N 50008149 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3-(2-ethylsulfanyl-propylcarbamoyl)-3,3-difluoro-2-oxo-propyl]-amide::CHEMBL30920 Cathepsin D Bos taurus 19 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008149&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278890 103921362 CHEMBL30920 ZINC29203107 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758992 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1 InChI=1S/C36H52F2N6O7/c1-2-9-28(40-33(47)30(25-27-12-7-4-8-13-27)42-35(49)44-18-22-51-23-19-44)32(46)41-29(24-26-10-5-3-6-11-26)31(45)36(37,38)34(48)39-14-15-43-16-20-50-21-17-43/h2,4,7-8,12-13,26,28-30H,1,3,5-6,9-11,14-25H2,(H,39,48)(H,40,47)(H,41,46)(H,42,49)/t28-,29-,30-/m0/s1 KUUQJUDFHATCIV-DTXPUJKBSA-N 50008145 CHEMBL286147::Morpholine-4-carboxylic acid (1-{1-[1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propylcarbamoyl]-but-3-enylcarbamoyl}-2-phenyl-ethyl)-amide Cathepsin D Bos taurus 33 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008145 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008145&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126583 103921358 CHEMBL286147 ZINC29207617 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758995 OC([C@H](Cc1ccccc1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H48F2N6O8S/c1-2-9-28(39-33(46)30(25-27-12-7-4-8-13-27)41-52(48,49)43-18-22-51-23-19-43)32(45)40-29(24-26-10-5-3-6-11-26)31(44)35(36,37)34(47)38-14-15-42-16-20-50-21-17-42/h2-8,10-13,28-31,41,44H,1,9,14-25H2,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30-,31?/m0/s1 QSZOFKRNYJCCES-PFDUYEAOSA-N 50008142 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-benzyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; CHCl3::CHEMBL28408 Cathepsin D Bos taurus 1828 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008142 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008142&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278822 103921355 CHEMBL28408 ZINC95608652 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758996 CCOC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C31H44F2N4O8S/c1-3-11-24(28(39)35-25(20-22-12-7-5-8-13-22)27(38)31(32,33)30(41)45-4-2)34-29(40)26(21-23-14-9-6-10-15-23)36-46(42,43)37-16-18-44-19-17-37/h3,6,9-10,14-15,22,24-26,36H,1,4-5,7-8,11-13,16-21H2,2H3,(H,34,40)(H,35,39)/t24-,25-,26-/m0/s1 AEIQMTCHERRLBO-GSDHBNRESA-N 50008122 5-Cyclohexyl-2,2-difluoro-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoylamino}-3-oxo-pentanoic acid ethyl ester; C13H24N2O::CHEMBL31679 Cathepsin D Bos taurus 69 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008122&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126556 103921335 CHEMBL31679 ZINC29203257 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758997 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(=O)C(F)(F)C(=O)NCCN2CCOCC2)cs1 InChI=1S/C36H52F2N8O8S2/c37-36(38,34(50)40-11-12-45-13-17-53-18-14-45)31(47)28(21-25-7-3-1-4-8-25)42-32(48)29(23-27-24-55-35(39)41-27)43-33(49)30(22-26-9-5-2-6-10-26)44-56(51,52)46-15-19-54-20-16-46/h2,5-6,9-10,24-25,28-30,44H,1,3-4,7-8,11-23H2,(H2,39,41)(H,40,50)(H,42,48)(H,43,49)/t28-,29-,30-/m0/s1 VALJKRUIJYUEIF-DTXPUJKBSA-N 50006856 4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; Hydrate::CHEMBL405227 Cathepsin D Bos taurus 3696 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50006856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50006856&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14990028 103920174 CHEMBL405227 ZINC95540359 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758998 COc1ccc(C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC2CCCCC2)C(O)C(F)(F)C(=O)NCCN2CCOCC2)cc1 InChI=1S/C36H56F2N6O9S/c1-3-7-29(40-34(47)31(25-27-10-12-28(51-2)13-11-27)42-54(49,50)44-18-22-53-23-19-44)33(46)41-30(24-26-8-5-4-6-9-26)32(45)36(37,38)35(48)39-14-15-43-16-20-52-21-17-43/h3,10-13,26,29-32,42,45H,1,4-9,14-25H2,2H3,(H,39,48)(H,40,47)(H,41,46)/t29-,30-,31-,32?/m0/s1 VMKHTPDJHSKOJB-WDJCGXDUSA-N 50008146 2-[3-(4-Methoxy-phenyl)-2-(morpholine-4-sulfonylamino)-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; Hydrate::CHEMBL280543 Cathepsin D Bos taurus 4570 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008146 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008146&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278974 103921359 CHEMBL280543 ZINC95541589 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50758999 COc1ccc(C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC2CCCCC2)C(=O)C(F)(F)C(=O)NCCN2CCOCC2)cc1 InChI=1S/C36H54F2N6O9S/c1-3-7-29(40-34(47)31(25-27-10-12-28(51-2)13-11-27)42-54(49,50)44-18-22-53-23-19-44)33(46)41-30(24-26-8-5-4-6-9-26)32(45)36(37,38)35(48)39-14-15-43-16-20-52-21-17-43/h3,10-13,26,29-31,42H,1,4-9,14-25H2,2H3,(H,39,48)(H,40,47)(H,41,46)/t29-,30-,31-/m0/s1 NCFJRHKEYXNDMF-CHQNGUEUSA-N 50008147 2-[3-(4-Methoxy-phenyl)-2-(morpholine-4-sulfonylamino)-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide; Hydrate::CHEMBL29103 Cathepsin D Bos taurus 71 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008147 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008147&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126573 103921360 CHEMBL29103 ZINC95542116 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759002 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C32H48F2N6O8S/c33-32(34,31(44)35-11-12-39-13-17-47-18-14-39)29(42)26(21-24-7-3-1-4-8-24)37-28(41)23-36-30(43)27(22-25-9-5-2-6-10-25)38-49(45,46)40-15-19-48-20-16-40/h2,5-6,9-10,24,26-27,38H,1,3-4,7-8,11-23H2,(H,35,44)(H,36,43)(H,37,41)/t26-,27-/m0/s1 PBGQFZPURRXBDN-SVBPBHIXSA-N 50008132 5-Cyclohexyl-2,2-difluoro-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-acetylamino}-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide::CHEMBL28702 Cathepsin D Bos taurus 67200 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008132&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126569 103921345 CHEMBL28702 ZINC28771604 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759003 FC(F)(C(=O)NCCc1ccccn1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C36H48F2N6O7S/c1-2-11-29(41-34(47)31(25-27-14-7-4-8-15-27)43-52(49,50)44-20-22-51-23-21-44)33(46)42-30(24-26-12-5-3-6-13-26)32(45)36(37,38)35(48)40-19-17-28-16-9-10-18-39-28/h2,4,7-10,14-16,18,26,29-31,43H,1,3,5-6,11-13,17,19-25H2,(H,40,48)(H,41,47)(H,42,46)/t29-,30-,31-/m0/s1 BNJKPFMWJCPMKT-CHQNGUEUSA-N 50008129 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-oxo-3-(2-pyridin-2-yl-ethylcarbamoyl)-propyl]-amide; Hydrate; CH3SO3H::CHEMBL281531 Cathepsin D Bos taurus 25 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008129&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126557 103921342 CHEMBL281531 ZINC95608468 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759005 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1cccnc1 InChI=1S/C39H52F2N6O6/c1-2-10-31(45-37(51)33(26-29-13-7-4-8-14-29)44-34(48)17-16-30-15-9-18-42-27-30)36(50)46-32(25-28-11-5-3-6-12-28)35(49)39(40,41)38(52)43-19-20-47-21-23-53-24-22-47/h2,4,7-9,13-15,18,27-28,31-33H,1,3,5-6,10-12,16-17,19-26H2,(H,43,52)(H,44,48)(H,45,51)(H,46,50)/t31-,32-,33-/m0/s1 RYIXIUHRDBEHJF-ZDCRTTOTSA-N 50008151 2-[3-Phenyl-2-(3-pyridin-3-yl-propionylamino)-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide::CHEMBL29323 Cathepsin D Bos taurus 1655 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008151&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126586 103921364 CHEMBL29323 ZINC29203559 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759006 OC([C@H](CC1CCCCC1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C32H50F2N6O8S/c33-32(34,31(44)35-11-12-39-13-17-47-18-14-39)29(42)26(21-24-7-3-1-4-8-24)37-28(41)23-36-30(43)27(22-25-9-5-2-6-10-25)38-49(45,46)40-15-19-48-20-16-40/h2,5-6,9-10,24,26-27,29,38,42H,1,3-4,7-8,11-23H2,(H,35,44)(H,36,43)(H,37,41)/t26-,27-,29?/m0/s1 VUTOFVCGSQQWKC-DARYULOESA-N 50008150 5-Cyclohexyl-2,2-difluoro-3-hydroxy-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-acetylamino}-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; CH2Cl2::CHEMBL31201 Cathepsin D Bos taurus >1000000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008150 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008150&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278755 103921363 CHEMBL31201 ZINC29203070 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759007 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H54F2N6O7/c1-2-9-28(40-33(47)30(25-27-12-7-4-8-13-27)42-35(49)44-18-22-51-23-19-44)32(46)41-29(24-26-10-5-3-6-11-26)31(45)36(37,38)34(48)39-14-15-43-16-20-50-21-17-43/h2,4,7-8,12-13,26,28-31,45H,1,3,5-6,9-11,14-25H2,(H,39,48)(H,40,47)(H,41,46)(H,42,49)/t28-,29-,30-,31?/m0/s1 NZZFIZGHHHMVHM-PFDUYEAOSA-N 50008153 CHEMBL32575::Morpholine-4-carboxylic acid (1-{1-[1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propylcarbamoyl]-but-3-enylcarbamoyl}-2-phenyl-ethyl)-amide; Hydrate Cathepsin D Bos taurus 2377 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008153 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008153&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44279063 103921366 CHEMBL32575 ZINC29205217 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759009 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCNCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H55F2N7O7S/c1-2-9-28(40-33(47)30(25-27-12-7-4-8-13-27)42-52(49,50)44-18-14-38-15-19-44)32(46)41-29(24-26-10-5-3-6-11-26)31(45)35(36,37)34(48)39-16-17-43-20-22-51-23-21-43/h2,4,7-8,12-13,26,28-31,38,42,45H,1,3,5-6,9-11,14-25H2,(H,39,48)(H,40,47)(H,41,46)/t28-,29-,30-,31?/m0/s1 CQXWWSJOBHMVPI-PFDUYEAOSA-N 50008154 2-[3-Phenyl-2-(piperazine-1-sulfonylamino)-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; Hydrate::CHEMBL31420 Cathepsin D Bos taurus 6850 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008154&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44279062 103921367 CHEMBL31420 ZINC95611889 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759013 CC[C@H](C)CNC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C InChI=1S/C39H62F2N6O8S/c1-7-15-30(34(49)44-31(24-28-16-11-9-12-17-28)33(48)39(40,41)36(51)42-26-27(3)8-2)43-35(50)32(25-29-18-13-10-14-19-29)45-56(53,54)47-22-20-46(21-23-47)37(52)55-38(4,5)6/h7,10,13-14,18-19,27-28,30-33,45,48H,1,8-9,11-12,15-17,20-26H2,2-6H3,(H,42,51)(H,43,50)(H,44,49)/t27-,30-,31-,32-,33?/m0/s1 XEJQSPNBNGMTCS-CVQLGRIRSA-N 50008157 4-(1-{1-[1-Cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-methyl-butylcarbamoyl)-propylcarbamoyl]-but-3-enylcarbamoyl}-2-phenyl-ethylsulfamoyl)-piperazine-1-carboxylic acid tert-butyl ester::CHEMBL32239 Cathepsin D Bos taurus 259 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008157&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44279012 103921370 CHEMBL32239 ZINC95608691 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759014 COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C34H52F2N6O10S/c1-50-32(46)28(39-30(44)27(23-25-10-6-3-7-11-25)40-53(48,49)42-16-20-52-21-17-42)31(45)38-26(22-24-8-4-2-5-9-24)29(43)34(35,36)33(47)37-12-13-41-14-18-51-19-15-41/h3,6-7,10-11,24,26-29,40,43H,2,4-5,8-9,12-23H2,1H3,(H,37,47)(H,38,45)(H,39,44)/t26-,27-,28+,29?/m0/s1 XZIVHTRFIFVIKV-YAZNYETNSA-N 50008125 CHEMBL285207::N-[1-Cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester; methyl alcohol Cathepsin D Bos taurus 17730 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008125&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278917 103921338 CHEMBL285207 ZINC95608517 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759015 Nc1nc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NS(=O)(=O)N2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(O)C(F)(F)C(=O)NCCN2CCOCC2)cs1 InChI=1S/C36H54F2N8O8S2/c37-36(38,34(50)40-11-12-45-13-17-53-18-14-45)31(47)28(21-25-7-3-1-4-8-25)42-32(48)29(23-27-24-55-35(39)41-27)43-33(49)30(22-26-9-5-2-6-10-26)44-56(51,52)46-15-19-54-20-16-46/h2,5-6,9-10,24-25,28-31,44,47H,1,3-4,7-8,11-23H2,(H2,39,41)(H,40,50)(H,42,48)(H,43,49)/t28-,29-,30-,31?/m0/s1 AWFZFBWKAUOZBA-PFDUYEAOSA-N 50008144 4-{3-(2-Amino-thiazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-5-cyclohexyl-2,2-difluoro-3-hydroxy-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; Hydrate::CHEMBL31889 Cathepsin D Bos taurus 95000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008144 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008144&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278756 103921357 CHEMBL31889 ZINC95611891 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759019 C[C@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C34H54F2N6O9S/c1-24(43)29(39-31(45)28(23-26-10-6-3-7-11-26)40-52(48,49)42-16-20-51-21-17-42)32(46)38-27(22-25-8-4-2-5-9-25)30(44)34(35,36)33(47)37-12-13-41-14-18-50-19-15-41/h3,6-7,10-11,24-25,27-30,40,43-44H,2,4-5,8-9,12-23H2,1H3,(H,37,47)(H,38,46)(H,39,45)/t24-,27-,28-,29-,30?/m0/s1 DLWUYAIVWSGEIY-JEOCPTAUSA-N 50368310 CHEMBL1790136 Cathepsin D Bos taurus 7946 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368310&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56678284 160847412 CHEMBL1790136 ZINC95543198 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759021 COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C34H50F2N6O10S/c1-50-32(46)28(39-30(44)27(23-25-10-6-3-7-11-25)40-53(48,49)42-16-20-52-21-17-42)31(45)38-26(22-24-8-4-2-5-9-24)29(43)34(35,36)33(47)37-12-13-41-14-18-51-19-15-41/h3,6-7,10-11,24,26-28,40H,2,4-5,8-9,12-23H2,1H3,(H,37,47)(H,38,45)(H,39,44)/t26-,27-,28+/m0/s1 ILVIKHFAJWQSOQ-HZFUHODCSA-N 50008162 CHEMBL31621::N-[1-Cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester; Hydrate Cathepsin D Bos taurus 515 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008162 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008162&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278975 103921375 CHEMBL31621 ZINC95541815 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759022 OC([C@H](NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(O)C(F)(F)C(=O)NCCN1CCOCC1)c1ccccc1 InChI=1S/C35H54F2N6O9S/c1-2-9-27(39-33(47)29(30(44)26-12-7-4-8-13-26)41-53(49,50)43-18-22-52-23-19-43)32(46)40-28(24-25-10-5-3-6-11-25)31(45)35(36,37)34(48)38-14-15-42-16-20-51-21-17-42/h2,4,7-8,12-13,25,27-31,41,44-45H,1,3,5-6,9-11,14-24H2,(H,38,48)(H,39,47)(H,40,46)/t27-,28-,29-,30?,31?/m0/s1 GNIIVXQGFBZGAC-VUTLOQLPSA-N 50008155 2-[3-Hydroxy-2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; Hydrate::CHEMBL32046 Cathepsin D Bos taurus >1000000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008155&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278956 103921368 CHEMBL32046 ZINC95540509 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759023 OC([C@@H](NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C1CCCCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C34H52F2N6O8S/c1-2-9-27(38-32(45)28(24-25-10-5-3-6-11-25)40-51(47,48)42-18-22-50-23-19-42)31(44)39-29(26-12-7-4-8-13-26)30(43)34(35,36)33(46)37-14-15-41-16-20-49-21-17-41/h2-3,5-6,10-11,26-30,40,43H,1,4,7-9,12-24H2,(H,37,46)(H,38,45)(H,39,44)/t27-,28-,29-,30?/m0/s1 WBECFFWGGMKGJK-UNVCSADESA-N 50008124 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; Hydrate::CHEMBL265316 Cathepsin D Bos taurus >1000000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008124&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278742 103921337 CHEMBL265316 ZINC29203570 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759024 CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H53F2N5O7/c1-5-12-27(40-32(46)29(24-26-15-10-7-11-16-26)42-34(48)50-35(2,3)4)31(45)41-28(23-25-13-8-6-9-14-25)30(44)36(37,38)33(47)39-17-18-43-19-21-49-22-20-43/h5,7,10-11,15-16,25,27-29H,1,6,8-9,12-14,17-24H2,2-4H3,(H,39,47)(H,40,46)(H,41,45)(H,42,48)/t27-,28-,29-/m0/s1 JPMKMPAXJXWYBK-AWCRTANDSA-N 50008160 (1-{1-[1-Cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propylcarbamoyl]-but-3-enylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL262385 Cathepsin D Bos taurus 1416 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008160 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008160&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126585 103921373 CHEMBL262385 ZINC29205356 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759025 CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H56F2N6O8S/c1-2-3-14-29(40-34(47)31(26-28-12-8-5-9-13-28)42-53(49,50)44-19-23-52-24-20-44)33(46)41-30(25-27-10-6-4-7-11-27)32(45)36(37,38)35(48)39-15-16-43-17-21-51-22-18-43/h5,8-9,12-13,27,29-31,42H,2-4,6-7,10-11,14-26H2,1H3,(H,39,48)(H,40,47)(H,41,46)/t29-,30-,31-/m0/s1 BTIJHFYMINAIMJ-CHQNGUEUSA-N 50008133 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-hexanoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide::CHEMBL31956 Cathepsin D Bos taurus 36 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008133&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126568 103921346 CHEMBL31956 ZINC95611893 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759026 OC([C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C35H54F2N6O8S/c1-2-9-28(39-33(46)30(25-27-12-7-4-8-13-27)41-52(48,49)43-18-22-51-23-19-43)32(45)40-29(24-26-10-5-3-6-11-26)31(44)35(36,37)34(47)38-14-15-42-16-20-50-21-17-42/h2,4,7-8,12-13,26,28-31,41,44H,1,3,5-6,9-11,14-25H2,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30-,31?/m0/s1 PVHMTQKFPXCDJQ-PFDUYEAOSA-N 50008156 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-2-hydroxy-3-(2-morpholin-4-yl-ethylcarbamoyl)-propyl]-amide; methyl alcohol::CHEMBL31550 Cathepsin D Bos taurus 2710 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008156&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278880 103921369 CHEMBL31550 ZINC95611890 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759028 CN1CCN(CC1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H55F2N7O7S/c1-3-10-29(40-34(48)31(26-28-13-8-5-9-14-28)42-53(50,51)45-19-17-43(2)18-20-45)33(47)41-30(25-27-11-6-4-7-12-27)32(46)36(37,38)35(49)39-15-16-44-21-23-52-24-22-44/h3,5,8-9,13-14,27,29-31,42H,1,4,6-7,10-12,15-26H2,2H3,(H,39,49)(H,40,48)(H,41,47)/t29-,30-,31-/m0/s1 YIJIVLJRFZJKEV-CHQNGUEUSA-N 50008131 2-[2-(4-Methyl-piperazine-1-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide; Hydrate::CHEMBL31268 Cathepsin D Bos taurus 728 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008131&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126584 103921344 CHEMBL31268 ZINC95611887 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759033 FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@@H](NS(=O)(=O)N1CCOCC1)C(=O)c1ccccc1 InChI=1S/C35H50F2N6O9S/c1-2-9-27(39-33(47)29(30(44)26-12-7-4-8-13-26)41-53(49,50)43-18-22-52-23-19-43)32(46)40-28(24-25-10-5-3-6-11-25)31(45)35(36,37)34(48)38-14-15-42-16-20-51-21-17-42/h2,4,7-8,12-13,25,27-29,41H,1,3,5-6,9-11,14-24H2,(H,38,48)(H,39,47)(H,40,46)/t27-,28-,29-/m0/s1 YXCQESFVPGIRPO-AWCRTANDSA-N 50008143 2-[2-(Morpholine-4-sulfonylamino)-3-oxo-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide; Hydrate::CHEMBL31438 Cathepsin D Bos taurus 1807 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008143 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008143&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278793 103921356 CHEMBL31438 ZINC95542108 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759035 OC([C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C36H54F2N8O8S/c37-36(38,35(50)40-11-12-45-13-17-53-18-14-45)32(47)29(21-26-7-3-1-4-8-26)42-33(48)30(23-28-24-39-25-41-28)43-34(49)31(22-27-9-5-2-6-10-27)44-55(51,52)46-15-19-54-20-16-46/h2,5-6,9-10,24-26,29-32,44,47H,1,3-4,7-8,11-23H2,(H,39,41)(H,40,50)(H,42,48)(H,43,49)/t29-,30-,31-,32?/m0/s1 BVPCJACDNLTJEX-WDJCGXDUSA-N 50008126 5-Cyclohexyl-2,2-difluoro-3-hydroxy-4-{3-(1H-imidazol-4-yl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-propionylamino}-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; methyl alcohol::CHEMBL28311 Cathepsin D Bos taurus >1000000 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008126&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278763 103921339 CHEMBL28311 ZINC95541448 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759036 CC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1 InChI=1S/C34H50F2N6O9S/c1-24(43)29(39-31(45)28(23-26-10-6-3-7-11-26)40-52(48,49)42-16-20-51-21-17-42)32(46)38-27(22-25-8-4-2-5-9-25)30(44)34(35,36)33(47)37-12-13-41-14-18-50-19-15-41/h3,6-7,10-11,25,27-29,40H,2,4-5,8-9,12-23H2,1H3,(H,37,47)(H,38,46)(H,39,45)/t27-,28-,29-/m0/s1 OZJSXGYSIKZBOF-AWCRTANDSA-N 50008140 5-Cyclohexyl-2,2-difluoro-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-3-oxo-butyrylamino}-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide; Hydrate::CHEMBL280818 Cathepsin D Bos taurus 202 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008140 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008140&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126570 103921353 CHEMBL280818 ZINC95608441 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757112 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CSC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H63N7O7S/c1-7-25(2)36(38(52)43-22-29-21-42-26(3)44-37(29)41)47-34(50)20-32(48)30(18-27-14-10-8-11-15-27)45-35(51)24-55-23-33(49)31(19-28-16-12-9-13-17-28)46-39(53)54-40(4,5)6/h9,12-13,16-17,21,25,27,30-33,36,48-49H,7-8,10-11,14-15,18-20,22-24H2,1-6H3,(H,43,52)(H,45,51)(H,46,53)(H,47,50)(H2,41,42,44)/t25-,30-,31-,32-,33+,36-/m0/s1 GHOSSUACYAUAKQ-ZWKLJLBZSA-N 50010409 CHEMBL112091::{3-[(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-methylsulfanyl]-1-benzyl-2-hydroxy-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 73000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010409 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010409&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 14301584 103923223 CHEMBL112091 ZINC95546302 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757114 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)N1CCC(CC1)C(O)=O)C(=O)NCc1cnc(C)nc1N InChI=1S/C42H63N9O8/c1-4-26(2)37(40(56)46-25-31-24-45-27(3)47-38(31)43)50-36(54)23-34(52)32(21-28-11-7-5-8-12-28)48-35(53)15-18-44-39(55)33(22-29-13-9-6-10-14-29)49-42(59)51-19-16-30(17-20-51)41(57)58/h6,9-10,13-14,24,26,28,30,32-34,37,52H,4-5,7-8,11-12,15-23,25H2,1-3H3,(H,44,55)(H,46,56)(H,48,53)(H,49,59)(H,50,54)(H,57,58)(H2,43,45,47)/t26-,32-,33+,34-,37-/m0/s1 STIKABWSDUATPK-YQRBTOPUSA-N 50010431 CHEMBL320726::[4-(Carboxypiperidino)carbonyl]-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010431&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44339968 103923245 CHEMBL320726 ZINC95610648 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757115 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@@H](CC1CCCCC1)NC(=O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cccnc1 InChI=1S/C39H58N6O7/c1-6-26(2)35(37(50)41-24-29-18-13-19-40-23-29)45-33(47)22-32(46)30(20-27-14-9-7-10-15-27)43-34(48)25-42-36(49)31(21-28-16-11-8-12-17-28)44-38(51)52-39(3,4)5/h8,11-13,16-19,23,26-27,30-32,35,46H,6-7,9-10,14-15,20-22,24-25H2,1-5H3,(H,41,50)(H,42,49)(H,43,48)(H,44,51)(H,45,47)/t26-,30+,31+,32-,35-/m0/s1 QFLMAWWUGVKQOP-KZLGYGLBSA-N 50010432 BOC-Phe-Gly-ACHPA-Ile N-(3-Pyridylmethyl)amide::CHEMBL109970 Cathepsin D Bos taurus 6500 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010432 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010432&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44339907 103923246 CHEMBL109970 ZINC26973299 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757118 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCCN)C(=O)NCc1cnc(C)nc1N InChI=1S/C41H65N9O6/c1-4-27(2)38(41(56)46-26-31-25-45-28(3)47-39(31)43)50-37(54)24-34(51)32(22-29-14-8-5-9-15-29)48-36(53)19-21-44-40(55)33(23-30-16-10-6-11-17-30)49-35(52)18-12-7-13-20-42/h6,10-11,16-17,25,27,29,32-34,38,51H,4-5,7-9,12-15,18-24,26,42H2,1-3H3,(H,44,55)(H,46,56)(H,48,53)(H,49,52)(H,50,54)(H2,43,45,47)/t27-,32-,33-,34-,38-/m0/s1 QFONWDPEYQXZGA-CQHIINNTSA-N 50368157 CHEMBL1203095 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368157&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15924500 160847259 CHEMBL1203095 ZINC95542072 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757119 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H61N9O7/c1-4-26(2)36(39(54)44-25-30-24-43-27(3)45-37(30)41)48-35(52)23-33(50)31(21-28-11-7-5-8-12-28)46-34(51)15-16-42-38(53)32(22-29-13-9-6-10-14-29)47-40(55)49-17-19-56-20-18-49/h6,9-10,13-14,24,26,28,31-33,36,50H,4-5,7-8,11-12,15-23,25H2,1-3H3,(H,42,53)(H,44,54)(H,46,51)(H,47,55)(H,48,52)(H2,41,43,45)/t26-,31-,32-,33-,36-/m0/s1 MTFKYPBHBWGHHE-JPBNRJMQSA-N 50010423 (Morpholinocarbonyl)-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL110553 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010423&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109762 103923237 CHEMBL110553 ZINC95546286 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757120 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H61N7O7/c1-7-25(2)36(38(52)43-24-29-23-42-26(3)44-37(29)41)47-35(51)22-33(49)31(21-28-16-12-9-13-17-28)45-34(50)19-18-32(48)30(20-27-14-10-8-11-15-27)46-39(53)54-40(4,5)6/h8,10-11,14-15,23,25,28,30-31,33,36,49H,7,9,12-13,16-22,24H2,1-6H3,(H,43,52)(H,45,50)(H,46,53)(H,47,51)(H2,41,42,44)/t25-,30-,31-,33-,36-/m0/s1 KICXJEMGCUTKSB-UNPUSGQVSA-N 50010420 CHEMBL325119::[4-(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-1-benzyl-2-oxo-butyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010420&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109749 103923234 CHEMBL325119 ZINC26976685 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757121 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CS(=O)CC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H61N7O8S/c1-7-25(2)36(38(52)43-22-29-21-42-26(3)44-37(29)41)47-34(50)20-32(48)30(18-27-14-10-8-11-15-27)45-35(51)24-56(54)23-33(49)31(19-28-16-12-9-13-17-28)46-39(53)55-40(4,5)6/h9,12-13,16-17,21,25,27,30-32,36,48H,7-8,10-11,14-15,18-20,22-24H2,1-6H3,(H,43,52)(H,45,51)(H,46,53)(H,47,50)(H2,41,42,44)/t25-,30-,31-,32-,36-,56?/m0/s1 OZAXHGSXTCHUBZ-IEQWJIHLSA-N 50010411 CHEMBL113209::{3-[(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-methanesulfinyl]-1-benzyl-2-oxo-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010411&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109734 103923225 CHEMBL113209 ZINC95546202 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757123 CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C40H62N8O7/c1-8-24(2)34(38(53)43-23-29-22-42-26(4)45-35(29)41)48-33(50)21-32(49)30(19-27-15-11-9-12-16-27)46-36(51)25(3)44-37(52)31(20-28-17-13-10-14-18-28)47-39(54)55-40(5,6)7/h10,13-14,17-18,22,24-25,27,30-32,34,49H,8-9,11-12,15-16,19-21,23H2,1-7H3,(H,43,53)(H,44,52)(H,46,51)(H,47,54)(H,48,50)(H2,41,42,45)/t24-,25-,30-,31-,32-,34-/m0/s1 ROYKKXNENWERFL-ZJEVERBASA-N 50010424 BOC-Phe-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL109380 Cathepsin D Bos taurus 28 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010424 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010424&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109747 103923238 CHEMBL109380 ZINC95546280 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50757127 CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)CSCC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C)C(=O)NCc1cnc(C)nc1N InChI=1S/C41H65N7O7S/c1-11-26(6)36(39(53)44-21-29-20-43-27(7)45-37(29)42)48-38(52)30(25(4)5)19-33(49)31(17-24(2)3)46-35(51)23-56-22-34(50)32(18-28-15-13-12-14-16-28)47-40(54)55-41(8,9)10/h12-16,20,24-26,30-33,36,49H,11,17-19,21-23H2,1-10H3,(H,44,53)(H,46,51)(H,47,54)(H,48,52)(H2,42,43,45)/t26-,30-,31-,32-,33-,36-/m0/s1 NBHPPUJYQFRWKJ-LXWVMJOTSA-N 50010412 BOC-Phe-psi[COCH2S]Gly-Leu-psi-[CHOHCH2]Val-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide::CHEMBL324213 Cathepsin D Bos taurus 8800 ChEMBL 10.1021/jm00115a016 10.7270/Q2G161FT 1956045 Raddatz, P; Jonczyk, A; Minck, KO; Schmitges, CJ; Sombroek, J E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50010412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50010412&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15109754 103923226 CHEMBL324213 ZINC95610778 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759040 CCOC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C31H46F2N4O8S/c1-3-11-24(28(39)35-25(20-22-12-7-5-8-13-22)27(38)31(32,33)30(41)45-4-2)34-29(40)26(21-23-14-9-6-10-15-23)36-46(42,43)37-16-18-44-19-17-37/h3,6,9-10,14-15,22,24-27,36,38H,1,4-5,7-8,11-13,16-21H2,2H3,(H,34,40)(H,35,39)/t24-,25-,26-,27?/m0/s1 RMVGKCQDVNQSGV-QPWGPPCNSA-N 50008161 5-Cyclohexyl-2,2-difluoro-3-hydroxy-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoylamino}-pentanoic acid ethyl ester; (CH3)2NCHO::CHEMBL284922 Cathepsin D Bos taurus 767 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008161 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008161&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278937 103921374 CHEMBL284922 ZINC29203898 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759042 CC[C@H](C)CNC(=O)C(F)(F)C(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C InChI=1S/C39H60F2N6O8S/c1-7-15-30(34(49)44-31(24-28-16-11-9-12-17-28)33(48)39(40,41)36(51)42-26-27(3)8-2)43-35(50)32(25-29-18-13-10-14-19-29)45-56(53,54)47-22-20-46(21-23-47)37(52)55-38(4,5)6/h7,10,13-14,18-19,27-28,30-32,45H,1,8-9,11-12,15-17,20-26H2,2-6H3,(H,42,51)(H,43,50)(H,44,49)/t27-,30-,31-,32-/m0/s1 MNARPUVTMSONDZ-QJANCWQKSA-N 50008152 4-(1-{1-[1-Cyclohexylmethyl-3,3-difluoro-3-(2-methyl-butylcarbamoyl)-2-oxo-propylcarbamoyl]-but-3-enylcarbamoyl}-2-phenyl-ethylsulfamoyl)-piperazine-1-carboxylic acid tert-butyl ester::CHEMBL29041 Cathepsin D Bos taurus 11 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008152&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 15126581 103921365 CHEMBL29041 ZINC95608612 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50759043 CCS[C@H](C)CNC(=O)C(F)(F)C(O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1 InChI=1S/C34H53F2N5O7S2/c1-4-12-27(38-32(44)29(22-26-15-10-7-11-16-26)40-50(46,47)41-17-19-48-20-18-41)31(43)39-28(21-25-13-8-6-9-14-25)30(42)34(35,36)33(45)37-23-24(3)49-5-2/h4,7,10-11,15-16,24-25,27-30,40,42H,1,5-6,8-9,12-14,17-23H2,2-3H3,(H,37,45)(H,38,44)(H,39,43)/t24-,27+,28+,29+,30?/m1/s1 CDQOVMFJRXQYFK-WRKOCOQLSA-N 50008158 2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3-(2-ethylsulfanyl-propylcarbamoyl)-3,3-difluoro-2-hydroxy-propyl]-amide::CHEMBL282756 Cathepsin D Bos taurus 37 ChEMBL 10.1021/jm00079a001 10.7270/Q22J6CGV 1732531 Doherty, AM; Sircar, I; Kornberg, BE; Quin, J; Winters, RT; Kaltenbronn, JS; Taylor, MD; Batley, BL; Rapundalo, SR; Ryan, MJ Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008158&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44278696 103921371 CHEMBL282756 ZINC29203268 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766516 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NC(C)C InChI=1S/C28H54N4O6/c1-12-18(7)23(31-26(36)24(19(8)13-2)32-27(37)38-28(9,10)11)25(35)30-20(14-16(3)4)21(33)15-22(34)29-17(5)6/h16-21,23-24,33H,12-15H2,1-11H3,(H,29,34)(H,30,35)(H,31,36)(H,32,37)/t18-,19-,20+,21?,23+,24+/m1/s1 GVUVNPKKNZINKS-CEZNVEGPSA-N 50368786 CHEMBL1791119 Cathepsin D Bos taurus 120 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368786&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56664754 160847888 CHEMBL1791119 ZINC58648431 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766518 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)[C@H](C)CC InChI=1S/C30H55N3O7/c1-9-20(5)26(28(37)31-22(16-19(3)4)24(34)18-25(35)39-10-2)33-27(36)23(17-21-14-12-11-13-15-21)32-29(38)40-30(6,7)8/h19-24,26,34H,9-18H2,1-8H3,(H,31,37)(H,32,38)(H,33,36)/t20-,22+,23+,24?,26+/m1/s1 FTHJSTXANKAZRW-BMRDAKNSSA-N 50368788 CHEMBL1791112 Cathepsin D Bos taurus 58 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368788&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56671625 160847890 CHEMBL1791112 ZINC27527256 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766530 CCC(C)[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O InChI=1S/C27H51N3O8/c1-12-16(4)21(23(34)28-18(13-15(2)3)19(31)14-20(32)33)29-24(35)22(17(5)37-26(6,7)8)30-25(36)38-27(9,10)11/h15-19,21-22,31H,12-14H2,1-11H3,(H,28,34)(H,29,35)(H,30,36)(H,32,33)/t16?,17-,18+,19?,21+,22+/m1/s1 FQNUHXFUIXFXDG-CTWQIRSUSA-N 50046828 4-[2-(3-tert-Butoxy-2-tert-butoxycarbonylamino-butyrylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoic acid::CHEMBL356791 Cathepsin D Bos taurus 1300 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046828 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046828&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10392668 103977528 CHEMBL356791 C03834 ZINC27524444 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766533 CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCN(C)CC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C39H61N5O5/c1-6-27(4)35(42-37(47)33(24-28-12-8-7-9-13-28)41-39(49)44-20-18-43(5)19-21-44)38(48)40-32(36(46)34(45)22-26(2)3)25-29-16-17-30-14-10-11-15-31(30)23-29/h10-11,14-17,23,26-28,32-36,45-46H,6-9,12-13,18-22,24-25H2,1-5H3,(H,40,48)(H,41,49)(H,42,47)/t27?,32-,33-,34-,35-,36+/m0/s1 WHESDQYRTIPYOT-BTMBRXEJSA-N 50046820 4-Methyl-piperazine-1-carboxylic acid {2-cyclohexyl-1-[1-(2,3-dihydroxy-5-methyl-1-naphthalen-2-ylmethyl-hexylcarbamoyl)-2-methyl-butylcarbamoyl]-ethyl}-amide::CHEMBL357865 Cathepsin D Bos taurus 1100 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046820 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046820&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10101068 103977520 CHEMBL357865 ZINC27548330 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766538 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N(C)CC(C)C InChI=1S/C30H58N4O6/c1-13-20(7)25(32-28(38)26(21(8)14-2)33-29(39)40-30(9,10)11)27(37)31-22(15-18(3)4)23(35)16-24(36)34(12)17-19(5)6/h18-23,25-26,35H,13-17H2,1-12H3,(H,31,37)(H,32,38)(H,33,39)/t20-,21-,22+,23?,25+,26+/m1/s1 PXEPJAOGMFSTFB-PEADLTECSA-N 50368795 CHEMBL1791129 Cathepsin D Bos taurus 58 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368795&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56661287 160847897 CHEMBL1791129 ZINC58513259 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766540 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCC(C)C InChI=1S/C30H58N4O6/c1-12-20(7)25(33-28(38)26(21(8)13-2)34-29(39)40-30(9,10)11)27(37)32-22(16-19(5)6)23(35)17-24(36)31-15-14-18(3)4/h18-23,25-26,35H,12-17H2,1-11H3,(H,31,36)(H,32,37)(H,33,38)(H,34,39)/t20-,21-,22+,23?,25+,26+/m1/s1 RLSZPUIXDYGDNR-PEADLTECSA-N 50368798 CHEMBL1791120 Cathepsin D Bos taurus 82 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368798&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56668166 160847900 CHEMBL1791120 ZINC58513104 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766547 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC(C)(C)C)C(C)CC InChI=1S/C29H55N3O8/c1-13-18(5)23(25(35)30-20(15-17(3)4)21(33)16-22(34)38-14-2)31-26(36)24(19(6)39-28(7,8)9)32-27(37)40-29(10,11)12/h17-21,23-24,33H,13-16H2,1-12H3,(H,30,35)(H,31,36)(H,32,37)/t18?,19-,20+,21?,23+,24+/m1/s1 HQFOINUBSRTORQ-CTOTTWEZSA-N 50046825 4-[2-(3-tert-Butoxy-2-tert-butoxycarbonylamino-butyrylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoic acid ethyl ester::CHEMBL143732 Cathepsin D Bos taurus 470 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046825 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046825&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10438059 103977525 CHEMBL143732 ZINC27524326 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766548 CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(O)=O)[C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(=O)N[C@@H](C(C)C)C(O)=O InChI=1S/C38H58N6O11/c1-10-20(5)29(42-33(48)30(21(6)11-2)43-34(49)31(36(52)53)44-37(54)55-38(7,8)9)32(47)40-25(16-22-18-39-24-15-13-12-14-23(22)24)26(45)17-27(46)41-28(19(3)4)35(50)51/h12-15,18-21,25-26,28-31,39,45H,10-11,16-17H2,1-9H3,(H,40,47)(H,41,46)(H,42,48)(H,43,49)(H,44,54)(H,50,51)(H,52,53)/t20-,21-,25+,26?,28+,29+,30+,31-/m1/s1 AZMVGFZDGMMMJI-YKMUQIPPSA-N 50368801 CHEMBL1791114 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368801&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56661286 160847903 CHEMBL1791114 ZINC95548164 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766552 CCOC(=O)CC(O)C(CC(C)C)NC(=O)C(NC(=O)C(NC(=O)OC(C)(C)C)C(C)(C)C)C(C)CC InChI=1S/C27H51N3O7/c1-12-17(5)21(23(33)28-18(14-16(3)4)19(31)15-20(32)36-13-2)29-24(34)22(26(6,7)8)30-25(35)37-27(9,10)11/h16-19,21-22,31H,12-15H2,1-11H3,(H,28,33)(H,29,34)(H,30,35) CLNVJQAYQULTSY-UHFFFAOYSA-N 50046826 4-[2-(2-tert-Butoxycarbonylamino-3,3-dimethyl-butyrylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoic acid ethyl ester::CHEMBL141337 Cathepsin D Bos taurus 280 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046826 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046826&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44362240 103977526 CHEMBL141337 ZINC36295325 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766565 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NC[C@@H](C)O InChI=1S/C28H54N4O7/c1-11-17(5)23(31-26(37)24(18(6)12-2)32-27(38)39-28(8,9)10)25(36)30-20(13-16(3)4)21(34)14-22(35)29-15-19(7)33/h16-21,23-24,33-34H,11-15H2,1-10H3,(H,29,35)(H,30,36)(H,31,37)(H,32,38)/t17-,18-,19-,20+,21?,23+,24+/m1/s1 WSOXTVRJXIBZOX-ZDNXQIFVSA-N 50368806 CHEMBL1791099 Cathepsin D Bos taurus 120 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368806&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56661285 160847908 CHEMBL1791099 ZINC72137630 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766571 CCOC(=O)CCNC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)CC)C(C)CC InChI=1S/C30H56N4O8/c1-11-19(6)25(33-28(39)26(20(7)12-2)34-29(40)42-30(8,9)10)27(38)32-21(16-18(4)5)22(35)17-23(36)31-15-14-24(37)41-13-3/h18-22,25-26,35H,11-17H2,1-10H3,(H,31,36)(H,32,38)(H,33,39)(H,34,40)/t19?,20?,21-,22?,25-,26-/m0/s1 WHXVDJWSDYFSQV-JDIRNYGHSA-N 50046842 3-{4-[2-(2-tert-Butoxycarbonylamino-3-methyl-pentanoylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoylamino}-propionic acid ethyl ester::CHEMBL141544 Cathepsin D Bos taurus 60 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046842&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10008735 103977542 CHEMBL141544 ZINC36295317 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766576 CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN1CCOCC1 InChI=1S/C34H63N5O7/c1-8-24(4)30(38-31(42)27(21-25-12-10-9-11-13-25)37-33(44)46-34(5,6)7)32(43)36-26(20-23(2)3)28(40)22-29(41)35-14-15-39-16-18-45-19-17-39/h23-28,30,40H,8-22H2,1-7H3,(H,35,41)(H,36,43)(H,37,44)(H,38,42)/t24-,26+,27+,28+,30+/m1/s1 YSIBIWDZONWTAW-IRSSOGQRSA-N 50368810 CHEMBL1791125 Cathepsin D Bos taurus 480 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368810 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368810&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56678377 160847912 CHEMBL1791125 ZINC27527141 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766582 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCCCO InChI=1S/C31H60N4O7/c1-10-21(5)26(34-29(40)27(22(6)11-2)35-30(41)42-31(7,8)9)28(39)33-23(18-20(3)4)24(37)19-25(38)32-16-14-12-13-15-17-36/h20-24,26-27,36-37H,10-19H2,1-9H3,(H,32,38)(H,33,39)(H,34,40)(H,35,41)/t21-,22-,23+,24?,26+,27+/m1/s1 CXGCHEZFTWDLBA-IJOAEDOZSA-N 50368814 CHEMBL1791126 Cathepsin D Bos taurus 68 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368814&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56675059 160847916 CHEMBL1791126 ZINC58512917 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766585 CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(O)=O InChI=1S/C33H50N4O7/c1-6-20(2)29(37-30(41)26(16-21-12-8-7-9-13-21)36-32(43)44-33(3,4)5)31(42)35-25(27(38)18-28(39)40)17-22-19-34-24-15-11-10-14-23(22)24/h10-11,14-15,19-21,25-27,29,34,38H,6-9,12-13,16-18H2,1-5H3,(H,35,42)(H,36,43)(H,37,41)(H,39,40)/t20?,25-,26-,27?,29-/m0/s1 BTJOVRIUFYIFDU-IEIUARPUSA-N 50046855 4-[2-(2-tert-Butoxycarbonylamino-3-cyclohexyl-propionylamino)-3-methyl-pentanoylamino]-3-hydroxy-5-(1H-indol-3-yl)-pentanoic acid::CHEMBL145539 Cathepsin D Bos taurus 12000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046855&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10100330 103977555 CHEMBL145539 C03834 ZINC27527214 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766586 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCCO InChI=1S/C30H58N4O7/c1-10-20(5)25(33-28(39)26(21(6)11-2)34-29(40)41-30(7,8)9)27(38)32-22(17-19(3)4)23(36)18-24(37)31-15-13-12-14-16-35/h19-23,25-26,35-36H,10-18H2,1-9H3,(H,31,37)(H,32,38)(H,33,39)(H,34,40)/t20?,21?,22-,23?,25-,26-/m0/s1 ZRYOCERIMLPMPB-NQWQDRRASA-N 50046856 CHEMBL143902::[1-(1-{1-[1-Hydroxy-2-(5-hydroxy-pentylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-methyl-butylcarbamoyl)-2-methyl-butyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 51 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046856&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10415945 103977556 CHEMBL143902 ZINC36295297 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766588 CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1cccc2ccccc12)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C38H59N3O6/c1-8-25(4)33(41-35(44)31(22-26-15-10-9-11-16-26)40-37(46)47-38(5,6)7)36(45)39-30(34(43)32(42)21-24(2)3)23-28-19-14-18-27-17-12-13-20-29(27)28/h12-14,17-20,24-26,30-34,42-43H,8-11,15-16,21-23H2,1-7H3,(H,39,45)(H,40,46)(H,41,44)/t25-,30+,31+,32+,33+,34-/m1/s1 GIGGAHIMLGCUKK-ABYSVDKJSA-N 50368799 CHEMBL1791102 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368799&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56668161 160847901 CHEMBL1791102 ZINC27546826 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766596 CCC(C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N1CCOCC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C38H58N4O6/c1-5-26(4)34(41-36(45)32(23-27-11-7-6-8-12-27)40-38(47)42-17-19-48-20-18-42)37(46)39-31(35(44)33(43)21-25(2)3)24-28-15-16-29-13-9-10-14-30(29)22-28/h9-10,13-16,22,25-27,31-35,43-44H,5-8,11-12,17-21,23-24H2,1-4H3,(H,39,46)(H,40,47)(H,41,45)/t26?,31-,32-,33-,34-,35+/m0/s1 KLNHCORKYXXGEP-JWEFNPAHSA-N 50046841 CHEMBL357864::Morpholine-4-carboxylic acid {2-cyclohexyl-1-[1-(2,3-dihydroxy-5-methyl-1-naphthalen-2-ylmethyl-hexylcarbamoyl)-2-methyl-butylcarbamoyl]-ethyl}-amide Cathepsin D Bos taurus 68 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046841&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 9939613 103977541 CHEMBL357864 ZINC27548325 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766597 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1cccc2ccccc12)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C35H55N3O6/c1-10-22(5)29(37-33(42)30(23(6)11-2)38-34(43)44-35(7,8)9)32(41)36-27(31(40)28(39)19-21(3)4)20-25-17-14-16-24-15-12-13-18-26(24)25/h12-18,21-23,27-31,39-40H,10-11,19-20H2,1-9H3,(H,36,41)(H,37,42)(H,38,43)/t22-,23-,27+,28+,29+,30+,31-/m1/s1 WAXSLZVOSFYPSX-RGUWEGDNSA-N 50368815 CHEMBL1791105 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368815 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368815&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56664752 160847917 CHEMBL1791105 ZINC27548317 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766598 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C35H55N3O6/c1-10-22(5)29(37-33(42)30(23(6)11-2)38-34(43)44-35(7,8)9)32(41)36-27(31(40)28(39)18-21(3)4)20-24-16-17-25-14-12-13-15-26(25)19-24/h12-17,19,21-23,27-31,39-40H,10-11,18,20H2,1-9H3,(H,36,41)(H,37,42)(H,38,43)/t22-,23-,27+,28+,29+,30+,31-/m1/s1 VNOUXPJNOOPPJR-RGUWEGDNSA-N 50368803 CHEMBL1791110 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368803&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56668164 160847905 CHEMBL1791110 ZINC27546698 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766600 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(O)=O InChI=1S/C30H46N4O7/c1-8-17(3)25(33-28(39)26(18(4)9-2)34-29(40)41-30(5,6)7)27(38)32-22(23(35)15-24(36)37)14-19-16-31-21-13-11-10-12-20(19)21/h10-13,16-18,22-23,25-26,31,35H,8-9,14-15H2,1-7H3,(H,32,38)(H,33,39)(H,34,40)(H,36,37)/t17-,18-,22+,23?,25+,26+/m1/s1 MQUMPAUFGWDMOG-PQEAIBHGSA-N 50368797 CHEMBL1791113 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368797&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56675057 160847899 CHEMBL1791113 C03834 ZINC72137683 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766603 CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(=O)N[C@@H](C(C)C)C(O)=O InChI=1S/C35H55N5O8/c1-10-20(5)29(39-32(44)30(21(6)11-2)40-34(47)48-35(7,8)9)31(43)37-25(16-22-18-36-24-15-13-12-14-23(22)24)26(41)17-27(42)38-28(19(3)4)33(45)46/h12-15,18-21,25-26,28-30,36,41H,10-11,16-17H2,1-9H3,(H,37,43)(H,38,42)(H,39,44)(H,40,47)(H,45,46)/t20-,21-,25+,26?,28+,29+,30+/m1/s1 SGLHSUCMCBCMGE-TUIVHCQHSA-N 50368816 CHEMBL1791121 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368816 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368816&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56678376 160847918 CHEMBL1791121 ZINC72137732 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766609 CCC(C)[C@H](NC(=O)[C@@H](N)CC1CCCCC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C33H51N3O4/c1-5-22(4)30(36-32(39)27(34)19-23-11-7-6-8-12-23)33(40)35-28(31(38)29(37)17-21(2)3)20-24-15-16-25-13-9-10-14-26(25)18-24/h9-10,13-16,18,21-23,27-31,37-38H,5-8,11-12,17,19-20,34H2,1-4H3,(H,35,40)(H,36,39)/t22?,27-,28-,29-,30-,31+/m0/s1 ZQTHHPUGDXRPQI-DVRBWYGUSA-N 50046861 2-(2-Amino-3-cyclohexyl-propionylamino)-3-methyl-pentanoic acid (2,3-dihydroxy-5-methyl-1-naphthalen-2-ylmethyl-hexyl)-amide; hydrochloride::CHEMBL543448 Cathepsin D Bos taurus 2500 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046861 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046861&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10099163 103977561 CHEMBL543448 ZINC27548635 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766613 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O InChI=1S/C25H47N3O7/c1-10-15(5)20(22(32)26-17(12-14(3)4)18(29)13-19(30)31)27-23(33)21(16(6)11-2)28-24(34)35-25(7,8)9/h14-18,20-21,29H,10-13H2,1-9H3,(H,26,32)(H,27,33)(H,28,34)(H,30,31)/t15?,16?,17-,18?,20-,21-/m0/s1 QJVBGGFSEUUFEP-MLJQLLOASA-N 50046821 4-[2-(2-tert-Butoxycarbonylamino-3-methyl-pentanoylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoic acid::CHEMBL356719 Cathepsin D Bos taurus 2600 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046821 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046821&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10006228 103977521 CHEMBL356719 C03834 ZINC36295327 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766621 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCCCO InChI=1S/C29H56N4O7/c1-10-19(5)24(32-27(38)25(20(6)11-2)33-28(39)40-29(7,8)9)26(37)31-21(16-18(3)4)22(35)17-23(36)30-14-12-13-15-34/h18-22,24-25,34-35H,10-17H2,1-9H3,(H,30,36)(H,31,37)(H,32,38)(H,33,39)/t19?,20?,21-,22?,24-,25-/m0/s1 JTMRUIJZKNZJRX-JCFUUELCSA-N 50046857 CHEMBL143596::[1-(1-{1-[1-Hydroxy-2-(4-hydroxy-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-methyl-butylcarbamoyl)-2-methyl-butyl]-carbamic acid tert-butyl ester Cathepsin D Bos taurus 82 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046857&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10053814 103977557 CHEMBL143596 ZINC36295301 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766626 CCC(C)C(NC(=O)C(NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)NC(CC(C)C)C(O)CC(O)=O InChI=1S/C25H47N3O7/c1-11-15(4)19(21(32)26-16(12-14(2)3)17(29)13-18(30)31)27-22(33)20(24(5,6)7)28-23(34)35-25(8,9)10/h14-17,19-20,29H,11-13H2,1-10H3,(H,26,32)(H,27,33)(H,28,34)(H,30,31) YFYJTMYWPJCXPG-UHFFFAOYSA-N 50046813 4-[2-(2-tert-Butoxycarbonylamino-3,3-dimethyl-butyrylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoic acid::CHEMBL343681 Cathepsin D Bos taurus 1100 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046813 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046813&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44362231 103977513 CHEMBL343681 C03834 ZINC36295309 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766632 CC[C@@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)CCC(O)=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C37H55N3O7/c1-5-24(4)34(40-36(46)30(21-25-11-7-6-8-12-25)38-32(42)17-18-33(43)44)37(47)39-29(35(45)31(41)19-23(2)3)22-26-15-16-27-13-9-10-14-28(27)20-26/h9-10,13-16,20,23-25,29-31,34-35,41,45H,5-8,11-12,17-19,21-22H2,1-4H3,(H,38,42)(H,39,47)(H,40,46)(H,43,44)/t24-,29+,30+,31+,34+,35-/m1/s1 DXQWXYPROWODLY-CVAXMTBMSA-N 50368802 CHEMBL1791097 Cathepsin D Bos taurus 60 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368802&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56681707 160847904 CHEMBL1791097 ZINC27548925 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50766616 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCCC(O)=O InChI=1S/C28H52N4O8/c1-10-17(5)23(31-26(38)24(18(6)11-2)32-27(39)40-28(7,8)9)25(37)30-19(14-16(3)4)20(33)15-21(34)29-13-12-22(35)36/h16-20,23-24,33H,10-15H2,1-9H3,(H,29,34)(H,30,37)(H,31,38)(H,32,39)(H,35,36)/t17?,18?,19-,20?,23-,24-/m0/s1 XVTCDIZSUXTOLE-FMUXTNLRSA-N 50046833 3-{4-[2-(2-tert-Butoxycarbonylamino-3-methyl-pentanoylamino)-3-methyl-pentanoylamino]-3-hydroxy-6-methyl-heptanoylamino}-propionic acid::CHEMBL145567 Cathepsin D Bos taurus 190 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50046833 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50046833&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10099584 103977533 CHEMBL145567 ZINC36310585 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770783 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)OP(O)(=O)CCCc1ccccc1 InChI=1S/C29H49N2O6P/c1-4-5-18-30-28(33)22(2)20-27(32)26(21-25-15-10-7-11-16-25)31-29(34)23(3)37-38(35,36)19-12-17-24-13-8-6-9-14-24/h6,8-9,13-14,22-23,25-27,32H,4-5,7,10-12,15-21H2,1-3H3,(H,30,33)(H,31,34)(H,35,36)/t22-,23+,26+,27+/m1/s1 MPIMSIROJYQCNO-DTBHQADXSA-N 50040380 (3-Phenyl-propyl)-phosphonic acid mono-[(S)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-ethyl] ester::CHEMBL146460 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040380 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040380&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10030516 103972437 CHEMBL146460 ZINC27556684 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770785 CCCCNC(=O)[C@@H](C)C[C@@H](O)[C@@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCCc1ccccc1 InChI=1S/C32H55N2O6P/c1-4-6-20-30(40-41(38,39)22-14-19-26-15-10-8-11-16-26)32(37)34-28(24-27-17-12-9-13-18-27)29(35)23-25(3)31(36)33-21-7-5-2/h8,10-11,15-16,25,27-30,35H,4-7,9,12-14,17-24H2,1-3H3,(H,33,36)(H,34,37)(H,38,39)/t25-,28+,29+,30-/m0/s1 MIHZWSQPXITQHW-XHDJHXHHSA-N 50040382 (3-Phenyl-propyl)-phosphonic acid mono-[(S)-1-((1R,2R,4S)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl] ester::CHEMBL344138 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040382 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040382&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364011 103972439 CHEMBL344138 ZINC27550845 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770789 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C InChI=1S/C28H46NO7P/c1-4-5-18-25(36-37(33,34)19-12-17-22-13-8-6-9-14-22)27(31)29-24(20-23-15-10-7-11-16-23)26(30)28(32)35-21(2)3/h6,8-9,13-14,21,23-26,30H,4-5,7,10-12,15-20H2,1-3H3,(H,29,31)(H,33,34)/t24-,25-,26+/m0/s1 DJDHRNOOCBDZKP-KKUQBAQOSA-N 50040389 (2R,3S)-4-Cyclohexyl-2-hydroxy-3-{(S)-2-[hydroxy-(3-phenyl-propyl)-phosphinoyloxy]-hexanoylamino}-butyric acid isopropyl ester::CHEMBL148625 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040389 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040389&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364143 103972446 CHEMBL148625 ZINC27558361 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770792 CCCCNC(=O)[C@@H](C)C[C@@H](O)[C@@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCCCc1ccccc1 InChI=1S/C33H57N2O6P/c1-4-6-21-31(41-42(39,40)23-15-14-18-27-16-10-8-11-17-27)33(38)35-29(25-28-19-12-9-13-20-28)30(36)24-26(3)32(37)34-22-7-5-2/h8,10-11,16-17,26,28-31,36H,4-7,9,12-15,18-25H2,1-3H3,(H,34,37)(H,35,38)(H,39,40)/t26-,29+,30+,31-/m0/s1 RVYNNDMCHVSLAJ-LDAZMUTJSA-N 50040391 (4-Phenyl-butyl)-phosphonic acid mono-[(S)-1-((1R,2R,4S)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl] ester::CHEMBL144696 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040391&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364010 103972448 CHEMBL144696 ZINC27550835 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770798 CCCCNC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CCCC)OP(O)(=O)CCCc1ccccc1)C(C)C InChI=1S/C31H55N2O6P/c1-7-9-18-29(39-40(37,38)20-14-17-25-15-12-11-13-16-25)31(36)33-27(21-23(3)4)28(34)22-26(24(5)6)30(35)32-19-10-8-2/h11-13,15-16,23-24,26-29,34H,7-10,14,17-22H2,1-6H3,(H,32,35)(H,33,36)(H,37,38)/t26-,27-,28-,29-/m0/s1 SHPKRKFYFPWCTG-DZUOILHNSA-N 50040390 (3-Phenyl-propyl)-phosphonic acid mono-[(S)-1-((1S,2S,4S)-4-butylcarbamoyl-2-hydroxy-1-isobutyl-5-methyl-hexylcarbamoyl)-pentyl] ester::CHEMBL421776 Cathepsin D Bos taurus 2300 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040390&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364036 103972447 CHEMBL421776 ZINC27555618 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770800 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCC)OP(O)(=O)CCCc1ccccc1 InChI=1S/C31H53N2O6P/c1-4-6-20-32-30(35)24(3)22-28(34)27(23-26-17-11-8-12-18-26)33-31(36)29(14-5-2)39-40(37,38)21-13-19-25-15-9-7-10-16-25/h7,9-10,15-16,24,26-29,34H,4-6,8,11-14,17-23H2,1-3H3,(H,32,35)(H,33,36)(H,37,38)/t24-,27+,28+,29+/m1/s1 NEIVDWDBIVCGCM-KHUDPXOFSA-N 50040383 (3-Phenyl-propyl)-phosphonic acid mono-[(S)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-butyl] ester::CHEMBL356144 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040383 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040383&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10031152 103972440 CHEMBL356144 ZINC27555800 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770809 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CCC)OP(O)(=O)CCCc1ccccc1 InChI=1S/C31H53N2O6P/c1-4-6-20-32-30(35)24(3)22-28(34)27(23-26-17-11-8-12-18-26)33-31(36)29(14-5-2)39-40(37,38)21-13-19-25-15-9-7-10-16-25/h7,9-10,15-16,24,26-29,34H,4-6,8,11-14,17-23H2,1-3H3,(H,32,35)(H,33,36)(H,37,38)/t24-,27+,28+,29-/m1/s1 NEIVDWDBIVCGCM-ZLPBPMGLSA-N 50040388 (3-Phenyl-propyl)-phosphonic acid mono-[(R)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-butyl] ester::CHEMBL144073 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040388 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040388&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 9985674 103972445 CHEMBL144073 ZINC27552415 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770811 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CCCC)OP(=O)(CCCc1ccccc1)OCC InChI=1S/C34H59N2O6P/c1-5-8-22-32(42-43(40,41-7-3)24-16-21-28-17-12-10-13-18-28)34(39)36-30(26-29-19-14-11-15-20-29)31(37)25-27(4)33(38)35-23-9-6-2/h10,12-13,17-18,27,29-32,37H,5-9,11,14-16,19-26H2,1-4H3,(H,35,38)(H,36,39)/t27-,30+,31+,32-,43?/m1/s1 SVELIFIDZRDCNX-HXMFWDKASA-N 50040392 (3-Phenyl-propyl)-phosphonic acid (R)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl ester ethyl ester::CHEMBL436607 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040392&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10077648 103972449 CHEMBL436607 ZINC27553837 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770813 CCCCNC(=O)[C@@H](C)C[C@@H](O)[C@@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCc1ccccc1 InChI=1S/C31H53N2O6P/c1-4-6-18-29(39-40(37,38)21-19-25-14-10-8-11-15-25)31(36)33-27(23-26-16-12-9-13-17-26)28(34)22-24(3)30(35)32-20-7-5-2/h8,10-11,14-15,24,26-29,34H,4-7,9,12-13,16-23H2,1-3H3,(H,32,35)(H,33,36)(H,37,38)/t24-,27+,28+,29-/m0/s1 VKKDPNMARMROOY-PAHDPSBJSA-N 50040396 CHEMBL342505::Phenethyl-phosphonic acid mono-[(S)-1-((1R,2R,4S)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl] ester Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040396 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040396&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44363833 103972453 CHEMBL342505 ZINC27550069 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770814 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCSc1ccccn1 InChI=1S/C31H47N2O5PS/c1-2-3-18-29(38-39(36,37)22-12-17-25-13-6-4-7-14-25)31(35)33-27(24-26-15-8-5-9-16-26)28(34)20-23-40-30-19-10-11-21-32-30/h4,6-7,10-11,13-14,19,21,26-29,34H,2-3,5,8-9,12,15-18,20,22-24H2,1H3,(H,33,35)(H,36,37)/t27-,28-,29-/m0/s1 YZBOMOUHKKEBDP-AWCRTANDSA-N 50040387 (3-Phenyl-propyl)-phosphonic acid mono-{(S)-1-[(1S,2S)-1-cyclohexylmethyl-2-hydroxy-4-(pyridin-2-ylsulfanyl)-butylcarbamoyl]-pentyl} ester::CHEMBL148073 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040387 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040387&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364072 103972444 CHEMBL148073 ZINC27555470 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770819 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(O)(=O)CCCc1ccccc1 InChI=1S/C32H55N2O6P/c1-4-6-20-30(40-41(38,39)22-14-19-26-15-10-8-11-16-26)32(37)34-28(24-27-17-12-9-13-18-27)29(35)23-25(3)31(36)33-21-7-5-2/h8,10-11,15-16,25,27-30,35H,4-7,9,12-14,17-24H2,1-3H3,(H,33,36)(H,34,37)(H,38,39)/t25-,28+,29+,30+/m1/s1 MIHZWSQPXITQHW-NYMHPOLGSA-N 50040384 (3-Phenyl-propyl)-phosphonic acid mono-[(S)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl] ester::CHEMBL144723 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040384 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040384&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10393697 103972441 CHEMBL144723 ZINC27552420 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770827 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](C)OP(O)(=O)CCCc1ccccc1 InChI=1S/C29H49N2O6P/c1-4-5-18-30-28(33)22(2)20-27(32)26(21-25-15-10-7-11-16-25)31-29(34)23(3)37-38(35,36)19-12-17-24-13-8-6-9-14-24/h6,8-9,13-14,22-23,25-27,32H,4-5,7,10-12,15-21H2,1-3H3,(H,30,33)(H,31,34)(H,35,36)/t22-,23-,26+,27+/m1/s1 MPIMSIROJYQCNO-YWUUFRFPSA-N 50040398 (3-Phenyl-propyl)-phosphonic acid mono-[(R)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-ethyl] ester::CHEMBL143837 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040398 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040398&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 10099128 103972455 CHEMBL143837 ZINC27552994 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770832 CCC[C@@H](OP(=O)(CCCc1ccccc1)OCC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)C1CC1 InChI=1S/C29H48NO6P/c1-3-12-26(36-37(34,35-4-2)20-11-17-22-13-7-5-8-14-22)29(33)30-25(21-23-15-9-6-10-16-23)28(32)27(31)24-18-19-24/h5,7-8,13-14,23-28,31-32H,3-4,6,9-12,15-21H2,1-2H3,(H,30,33)/t25-,26+,27-,28+,37?/m0/s1 PQTNBOHYXFCJGW-GQONXMRXSA-N 50040393 (3-Phenyl-propyl)-phosphonic acid (R)-1-((1S,2R,3S)-1-cyclohexylmethyl-3-cyclopropyl-2,3-dihydroxy-propylcarbamoyl)-butyl ester ethyl ester::CHEMBL144812 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040393&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44363870 103972450 CHEMBL144812 ZINC27553146 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770834 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(O)CC(C)C InChI=1S/C29H50NO6P/c1-4-5-18-27(36-37(34,35)19-12-17-23-13-8-6-9-14-23)29(33)30-25(21-24-15-10-7-11-16-24)28(32)26(31)20-22(2)3/h6,8-9,13-14,22,24-28,31-32H,4-5,7,10-12,15-21H2,1-3H3,(H,30,33)(H,34,35)/t25-,26?,27-,28+/m0/s1 IGATXWPIMVWZBU-KCCLQJLHSA-N 50040395 (3-Phenyl-propyl)-phosphonic acid mono-[(S)-1-((1S,2R)-1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-pentyl] ester::CHEMBL144349 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040395 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040395&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364025 103972452 CHEMBL144349 ZINC27552234 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770838 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OC(=O)c1ccccc1 InChI=1S/C39H59N2O7P/c1-4-6-25-36(47-49(46,27-17-22-31-18-11-8-12-19-31)48-39(45)33-23-15-10-16-24-33)38(44)41-34(29-32-20-13-9-14-21-32)35(42)28-30(3)37(43)40-26-7-5-2/h8,10-12,15-16,18-19,23-24,30,32,34-36,42H,4-7,9,13-14,17,20-22,25-29H2,1-3H3,(H,40,43)(H,41,44)/t30-,34+,35+,36+,49?/m1/s1 DFOCXJWVMPSDCT-UWKZYUMSSA-N 50040394 (2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(less polar)::(2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(more polar)::CHEMBL146651 Cathepsin D Bos taurus 2650 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040394&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44364156 103972451 CHEMBL146651 ZINC27557416 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770839 CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OCC InChI=1S/C34H59N2O6P/c1-5-8-22-32(42-43(40,41-7-3)24-16-21-28-17-12-10-13-18-28)34(39)36-30(26-29-19-14-11-15-20-29)31(37)25-27(4)33(38)35-23-9-6-2/h10,12-13,17-18,27,29-32,37H,5-9,11,14-16,19-26H2,1-4H3,(H,35,38)(H,36,39)/t27-,30+,31+,32+,43?/m1/s1 SVELIFIDZRDCNX-WVPWFCJLSA-N 50040386 (3-Phenyl-propyl)-phosphonic acid (S)-1-((1S,2S,4R)-4-butylcarbamoyl-1-cyclohexylmethyl-2-hydroxy-pentylcarbamoyl)-pentyl ester ethyl ester::CHEMBL147879 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50040386 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50040386&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 9895340 103972443 CHEMBL147879 ZINC14279387 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50770845 CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CC(=O)N[C@H]([C@@H](C)CC)C(=O)NCc1cnc(C)nc1N InChI=1S/C38H61N6O7P/c1-5-7-20-33(51-52(49,50)21-14-19-28-15-10-8-11-16-28)37(47)43-31(22-29-17-12-9-13-18-29)32(45)23-34(46)44-35(26(3)6-2)38(48)41-25-30-24-40-27(4)42-36(30)39/h8,10-11,15-16,24,26,29,31-33,35,45H,5-7,9,12-14,17-23,25H2,1-4H3,(H,41,48)(H,43,47)(H,44,46)(H,49,50)(H2,39,40,42)/t26-,31-,32-,33-,35+/m0/s1 KFDDSLXXEXBNTO-NLVSJJSZSA-N 50368956 CHEMBL1791135 Cathepsin D Bos taurus >10000 ChEMBL 10.1021/jm00030a008 10.7270/Q2MW2HTW 8120867 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ E. Merck Darmstadt http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50368956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50368956&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 56678327 160848058 CHEMBL1791135 ZINC27553014 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992274 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCC(C)C InChI=1S/C29H56N4O6/c1-12-19(7)24(32-27(37)25(20(8)13-2)33-28(38)39-29(9,10)11)26(36)31-21(14-17(3)4)22(34)15-23(35)30-16-18(5)6/h17-22,24-25,34H,12-16H2,1-11H3,(H,30,35)(H,31,36)(H,32,37)(H,33,38)/t19-,20-,21-,22?,24-,25-/m0/s1 NDYYXVKIFGODKU-RCWCPIMJSA-N 50407078 CHEMBL2112272 Cathepsin D Bos taurus 65 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407078&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71454451 163356102 CHEMBL2112272 ZINC36295313 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992275 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C38H59N3O6/c1-8-25(4)33(41-35(44)31(22-26-14-10-9-11-15-26)40-37(46)47-38(5,6)7)36(45)39-30(34(43)32(42)20-24(2)3)23-27-18-19-28-16-12-13-17-29(28)21-27/h12-13,16-19,21,24-26,30-34,42-43H,8-11,14-15,20,22-23H2,1-7H3,(H,39,45)(H,40,46)(H,41,44)/t25-,30-,31-,32-,33-,34+/m0/s1 WOTVFZVYVNFVGQ-AGKYWFPGSA-N 50407080 CHEMBL2112254 Cathepsin D Bos taurus 63 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407080&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 9809765 163356104 CHEMBL2112254 ZINC27547651 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992276 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C31H59N3O6/c1-10-20(5)25(33-29(38)26(21(6)11-2)34-30(39)40-31(7,8)9)28(37)32-23(18-22-15-13-12-14-16-22)27(36)24(35)17-19(3)4/h19-27,35-36H,10-18H2,1-9H3,(H,32,37)(H,33,38)(H,34,39)/t20-,21-,23-,24-,25-,26-,27+/m0/s1 QCJGETVAMMABIO-XFNMXBBLSA-N 50407071 CHEMBL2112257 Cathepsin D Bos taurus 61 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407071&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 18654288 163356095 CHEMBL2112257 ZINC27547656 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992277 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCC1)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O InChI=1S/C27H49N3O7/c1-8-17(4)22(24(34)28-19(14-16(2)3)20(31)15-21(32)33)29-25(35)23(18-12-10-9-11-13-18)30-26(36)37-27(5,6)7/h16-20,22-23,31H,8-15H2,1-7H3,(H,28,34)(H,29,35)(H,30,36)(H,32,33)/t17-,19-,20?,22-,23-/m0/s1 OJTMLSFMMJZVBH-HAEKHIIKSA-N 50407073 CHEMBL2112260 Cathepsin D Bos taurus 350 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407073 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407073&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71450857 163356097 CHEMBL2112260 C03834 ZINC27547920 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992278 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCC1)[C@@H](C)CC InChI=1S/C29H53N3O7/c1-9-19(5)24(26(35)30-21(16-18(3)4)22(33)17-23(34)38-10-2)31-27(36)25(20-14-12-11-13-15-20)32-28(37)39-29(6,7)8/h18-22,24-25,33H,9-17H2,1-8H3,(H,30,35)(H,31,36)(H,32,37)/t19-,21-,22?,24-,25-/m0/s1 IVZIEQBJFWEIMD-LGCXHFNYSA-N 50407081 CHEMBL2112256 Cathepsin D Bos taurus 93 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407081&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71454447 163356105 CHEMBL2112256 ZINC27526548 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992279 CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O InChI=1S/C26H49N3O7/c1-11-16(4)21(23(34)27-17(12-15(2)3)19(30)13-20(31)32)29-22(33)18(14-25(5,6)7)28-24(35)36-26(8,9)10/h15-19,21,30H,11-14H2,1-10H3,(H,27,34)(H,28,35)(H,29,33)(H,31,32)/t16-,17-,18-,19?,21-/m0/s1 NFWGGZOXEYJKCJ-LGNHTBRNSA-N 50407082 CHEMBL2112836 Cathepsin D Bos taurus 150 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407082&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71452707 163356106 CHEMBL2112836 C03834 ZINC13861398 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992282 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)NCC1CCCCC1 InChI=1S/C32H60N4O6/c1-10-21(5)27(35-30(40)28(22(6)11-2)36-31(41)42-32(7,8)9)29(39)34-24(17-20(3)4)25(37)18-26(38)33-19-23-15-13-12-14-16-23/h20-25,27-28,37H,10-19H2,1-9H3,(H,33,38)(H,34,39)(H,35,40)(H,36,41)/t21-,22-,24-,25?,27-,28-/m0/s1 KOEQMVDCLYAUJM-GGNQWCFRSA-N 50407084 CHEMBL2112271 Cathepsin D Bos taurus 540 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407084&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71450859 163356108 CHEMBL2112271 ZINC36295345 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992289 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C34H63N3O6/c1-8-23(4)29(32(41)35-26(20-24-15-11-9-12-16-24)30(39)28(38)19-22(2)3)37-31(40)27(21-25-17-13-10-14-18-25)36-33(42)43-34(5,6)7/h22-30,38-39H,8-21H2,1-7H3,(H,35,41)(H,36,42)(H,37,40)/t23-,26-,27-,28-,29-,30+/m0/s1 CSTWSEPSGWXLDX-BRHZJGCFSA-N 50407088 CHEMBL2112255 Cathepsin D Bos taurus 55 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407088&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71454446 163356112 CHEMBL2112255 ZINC27547118 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992291 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(C)=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C35H53N3O5/c1-6-23(4)32(38-34(42)30(36-24(5)39)20-25-12-8-7-9-13-25)35(43)37-29(33(41)31(40)18-22(2)3)21-26-16-17-27-14-10-11-15-28(27)19-26/h10-11,14-17,19,22-23,25,29-33,40-41H,6-9,12-13,18,20-21H2,1-5H3,(H,36,39)(H,37,43)(H,38,42)/t23-,29-,30-,31-,32-,33+/m0/s1 LQCJJENFTPZACS-CKMCQWPASA-N 50407089 CHEMBL2112253 Cathepsin D Bos taurus 180 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407089&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71450856 163356113 CHEMBL2112253 ZINC03915536 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992293 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NS(=O)(=O)N1CCN(C)CC1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C38H61N5O6S/c1-6-27(4)35(40-37(46)33(24-28-12-8-7-9-13-28)41-50(48,49)43-20-18-42(5)19-21-43)38(47)39-32(36(45)34(44)22-26(2)3)25-29-16-17-30-14-10-11-15-31(30)23-29/h10-11,14-17,23,26-28,32-36,41,44-45H,6-9,12-13,18-22,24-25H2,1-5H3,(H,39,47)(H,40,46)/t27-,32-,33-,34-,35-,36+/m0/s1 ULOCIXFRXPKOGB-LREHCXSPSA-N 50407074 CHEMBL2112267 Cathepsin D Bos taurus 110 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407074&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71461613 163356098 CHEMBL2112267 ZINC27548237 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992297 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N[C@@H](C(C)C)C(=O)NC(CC(N)=O)C(=O)NC[C@@H](C)O InChI=1S/C37H69N7O10/c1-13-21(7)30(43-35(52)31(22(8)14-2)44-36(53)54-37(10,11)12)34(51)40-24(15-19(3)4)26(46)17-28(48)42-29(20(5)6)33(50)41-25(16-27(38)47)32(49)39-18-23(9)45/h19-26,29-31,45-46H,13-18H2,1-12H3,(H2,38,47)(H,39,49)(H,40,51)(H,41,50)(H,42,48)(H,43,52)(H,44,53)/t21-,22-,23+,24-,25?,26?,29-,30-,31-/m0/s1 HZYGFGFQBHMYQZ-ULORJZGDSA-N 50407083 CHEMBL2112251 Cathepsin D Bos taurus 200 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407083&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71454445 163356107 CHEMBL2112251 ZINC95606828 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992299 CCOC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@@H](C)CC InChI=1S/C27H51N3O7/c1-11-17(6)22(24(33)28-19(14-16(4)5)20(31)15-21(32)36-13-3)29-25(34)23(18(7)12-2)30-26(35)37-27(8,9)10/h16-20,22-23,31H,11-15H2,1-10H3,(H,28,33)(H,29,34)(H,30,35)/t17-,18+,19-,20-,22-,23-/m0/s1 MIRAMMMXFXHKPC-QPJCPEQFSA-N 50407086 CHEMBL2112265 Cathepsin D Bos taurus 21 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407086&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71456200 163356110 CHEMBL2112265 ZINC27526419 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992305 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(N)=O InChI=1S/C25H48N4O6/c1-10-15(5)20(22(32)27-17(12-14(3)4)18(30)13-19(26)31)28-23(33)21(16(6)11-2)29-24(34)35-25(7,8)9/h14-18,20-21,30H,10-13H2,1-9H3,(H2,26,31)(H,27,32)(H,28,33)(H,29,34)/t15-,16-,17-,18?,20-,21-/m0/s1 BRTBRESKDDRILO-RVPRXVRWSA-N 50407091 CHEMBL2112266 Cathepsin D Bos taurus 410 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407091&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71454450 163356115 CHEMBL2112266 ZINC13861396 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992307 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN(C)C InChI=1S/C32H61N5O6/c1-10-22(4)28(30(41)34-24(18-21(2)3)26(38)20-27(39)33-16-17-37(8)9)36-29(40)25(19-23-14-12-11-13-15-23)35-31(42)43-32(5,6)7/h21-26,28,38H,10-20H2,1-9H3,(H,33,39)(H,34,41)(H,35,42)(H,36,40)/t22-,24-,25-,26-,28-/m0/s1 BOSPICWLJZJSAX-FVCDFAAQSA-N 50407072 CHEMBL2112269 Cathepsin D Bos taurus 300 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407072&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71461614 163356096 CHEMBL2112269 ZINC27548090 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992308 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCc1ccccn1 InChI=1S/C35H59N5O6/c1-8-24(4)31(40-32(43)28(21-25-14-10-9-11-15-25)39-34(45)46-35(5,6)7)33(44)38-27(20-23(2)3)29(41)22-30(42)37-19-17-26-16-12-13-18-36-26/h12-13,16,18,23-25,27-29,31,41H,8-11,14-15,17,19-22H2,1-7H3,(H,37,42)(H,38,44)(H,39,45)(H,40,43)/t24-,27-,28-,29-,31-/m0/s1 QZHUFCAPALTNSM-LRLYEUBCSA-N 50407087 CHEMBL2112258 Cathepsin D Bos taurus 37 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407087&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71454448 163356111 CHEMBL2112258 ZINC27547346 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992309 CCOC(=O)C[C@@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H](C)CC InChI=1S/C27H51N3O7/c1-11-17(6)22(24(33)28-19(14-16(4)5)20(31)15-21(32)36-13-3)29-25(34)23(18(7)12-2)30-26(35)37-27(8,9)10/h16-20,22-23,31H,11-15H2,1-10H3,(H,28,33)(H,29,34)(H,30,35)/t17-,18-,19-,20+,22-,23-/m0/s1 MIRAMMMXFXHKPC-ACXQXYJUSA-N 50407077 CHEMBL2112264 Cathepsin D Bos taurus 160 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407077&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71450858 163356101 CHEMBL2112264 ZINC27526411 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992311 CCOC(=O)CC(O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)(C)C)NC(=O)OC(C)(C)C)[C@@H](C)CC InChI=1S/C28H53N3O7/c1-12-18(5)23(25(35)29-19(14-17(3)4)21(32)15-22(33)37-13-2)31-24(34)20(16-27(6,7)8)30-26(36)38-28(9,10)11/h17-21,23,32H,12-16H2,1-11H3,(H,29,35)(H,30,36)(H,31,34)/t18-,19-,20-,21?,23-/m0/s1 IYGHIWIHYRBLGU-SMVREUAISA-N 50407090 CHEMBL2112837 Cathepsin D Bos taurus 72 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407090&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71450899 163356114 CHEMBL2112837 ZINC95607522 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992313 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)CC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@H](C)O InChI=1S/C32H60N6O9/c1-11-18(5)26(37-30(45)27(19(6)12-2)38-31(46)47-32(8,9)10)29(44)36-21(13-17(3)4)23(40)15-25(42)35-22(14-24(33)41)28(43)34-16-20(7)39/h17-23,26-27,39-40H,11-16H2,1-10H3,(H2,33,41)(H,34,43)(H,35,42)(H,36,44)(H,37,45)(H,38,46)/t18-,19-,20-,21-,22-,23?,26-,27-/m0/s1 KNZNEBJKRKXBAJ-MAMPMTGXSA-N 50407069 CHEMBL2112252 Cathepsin D Bos taurus 1700 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407069&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71461610 163356093 CHEMBL2112252 ZINC49748407 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992314 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)CC(=O)N[C@@H](C(C)C)C(O)=O InChI=1S/C38H59N5O8/c1-8-23(4)33(43-34(46)29(18-24-14-10-9-11-15-24)41-37(50)51-38(5,6)7)35(47)40-28(19-25-21-39-27-17-13-12-16-26(25)27)30(44)20-31(45)42-32(22(2)3)36(48)49/h12-13,16-17,21-24,28-30,32-33,39,44H,8-11,14-15,18-20H2,1-7H3,(H,40,47)(H,41,50)(H,42,45)(H,43,46)(H,48,49)/t23-,28-,29-,30?,32-,33-/m0/s1 WRNYZKXDJHJYDF-BMNPDWMFSA-N 50407085 CHEMBL2112259 Cathepsin D Bos taurus 620 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407085&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71452681 163356109 CHEMBL2112259 ZINC27547359 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992264 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C36H58N4O6/c1-8-23(4)31(40-33(43)29(19-24-14-10-9-11-15-24)39-35(45)46-36(5,6)7)34(44)38-28(32(42)30(41)18-22(2)3)20-25-21-37-27-17-13-12-16-26(25)27/h12-13,16-17,21-24,28-32,37,41-42H,8-11,14-15,18-20H2,1-7H3,(H,38,44)(H,39,45)(H,40,43)/t23-,28-,29-,30-,31-,32+/m0/s1 QPHBZNSUEDRPBX-TYOPREAOSA-N 50407075 CHEMBL2112262 Cathepsin D Bos taurus 210 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407075&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71461612 163356099 CHEMBL2112262 ZINC27547108 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992269 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)CC(O)=O InChI=1S/C28H51N3O7/c1-8-18(4)24(26(36)29-20(14-17(2)3)22(32)16-23(33)34)31-25(35)21(15-19-12-10-9-11-13-19)30-27(37)38-28(5,6)7/h17-22,24,32H,8-16H2,1-7H3,(H,29,36)(H,30,37)(H,31,35)(H,33,34)/t18-,20-,21-,22?,24-/m0/s1 QIOMPQZQWLOGOE-JUQSBVICSA-N 50407079 CHEMBL2112261 Cathepsin D Bos taurus 130 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407079&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71461611 163356103 CHEMBL2112261 C03834 ZINC27546714 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992271 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)N(C)CCN(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C InChI=1S/C39H63N5O5/c1-8-27(4)35(42-37(47)33(24-28-14-10-9-11-15-28)41-39(49)44(7)21-20-43(5)6)38(48)40-32(36(46)34(45)22-26(2)3)25-29-18-19-30-16-12-13-17-31(30)23-29/h12-13,16-19,23,26-28,32-36,45-46H,8-11,14-15,20-22,24-25H2,1-7H3,(H,40,48)(H,41,49)(H,42,47)/t27-,32-,33-,34-,35-,36+/m0/s1 KSTOBDMSDPHGEE-LREHCXSPSA-N 50407070 CHEMBL2112268 Cathepsin D Bos taurus 280 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407070&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71458001 163356094 CHEMBL2112268 ZINC03915538 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50992273 CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCC(C)C InChI=1S/C32H60N4O6/c1-10-22(6)28(30(40)34-24(16-20(2)3)26(37)18-27(38)33-19-21(4)5)36-29(39)25(17-23-14-12-11-13-15-23)35-31(41)42-32(7,8)9/h20-26,28,37H,10-19H2,1-9H3,(H,33,38)(H,34,40)(H,35,41)(H,36,39)/t22-,24-,25-,26-,28-/m0/s1 HFWXMIVGMOQFCK-FVCDFAAQSA-N 50407076 CHEMBL2112270 Cathepsin D Bos taurus 16 ChEMBL 10.1021/jm00056a007 10.7270/Q2PC331F 8474103 Shiosaki, K; Tasker, AS; Sullivan, GM; Sorensen, BK; von Geldern, TW; Wu-Wong, JR; Marselle, CA; Opgenorth, TJ Abbott Laboratories http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50407076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50407076&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 71452682 163356100 CHEMBL2112270 ZINC27547455 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50991205 CSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C InChI=1S/C31H48N4O7S/c1-21(2)42-30(39)27(36)24(18-22-10-6-4-7-11-22)32-29(38)26(20-43-3)33-28(37)25(19-23-12-8-5-9-13-23)34-31(40)35-14-16-41-17-15-35/h5,8-9,12-13,21-22,24-27,36H,4,6-7,10-11,14-20H2,1-3H3,(H,32,38)(H,33,37)(H,34,40)/t24-,25-,26-,27+/m0/s1 UZQBKCWYZBHBOW-YIPNQBBMSA-N 50282993 (2S,4R)-4-Cyclohexyl-2-hydroxy-3-((R)-3-methylsulfanyl-2-{2-[(morpholine-4-carbonyl)-amino]-3-phenyl-propionylamino}-propionylamino)-butyric acid isopropyl ester::CHEMBL60550 Cathepsin D Bos taurus 24 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282993 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282993&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 2ZS 1EPN,1GVT 64922 104124667 CHEMBL60550 C03800 ZINC03927469 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 51031484 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1 FAXGPCHRFPCXOO-LXTPJMTPSA-N 912 (3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanamido]propanamido]-6-methylheptanoic acid::CHEMBL296588::Iva-Val-Val-Sta-Ala-Sta-OH::N-[(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl]-4-amino-3-hydroxy-6-methylheptanoic acid::PEPSTATIN::Pepstatine::US9115083, Pepstatin Cathepsin D Bos taurus 10.0 ChEMBL 10.1021/jm00172a005 10.7270/Q2N29XJZ 2120440 Iizuka, K; Kamijo, T; Harada, H; Akahane, K; Kubota, T; Umeyama, H; Ishida, T; Kiso, Y Kissei Pharmaceutical Company Ltd http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=912&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 1IZE,1LS5,1M43,1SME,1W6I,1XDH,2H6T,2QZX,3EMY 5478883 8030793 CHEMBL296588 C03834 ZINC38148052 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 51030978 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1 FAXGPCHRFPCXOO-LXTPJMTPSA-N 912 (3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanamido]propanamido]-6-methylheptanoic acid::CHEMBL296588::Iva-Val-Val-Sta-Ala-Sta-OH::N-[(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl]-4-amino-3-hydroxy-6-methylheptanoic acid::PEPSTATIN::Pepstatine::US9115083, Pepstatin Cathepsin D Bos taurus 28 ChEMBL 10.1021/jm00149a001 10.7270/Q23B60QP 3906126 Thaisrivongs, S; Pals, DT; Kati, WM; Turner, SR; Thomasco, LM TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=912&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 1IZE,1LS5,1M43,1SME,1W6I,1XDH,2H6T,2QZX,3EMY 5478883 8030793 CHEMBL296588 C03834 ZINC38148052 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 51031026 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1 FAXGPCHRFPCXOO-LXTPJMTPSA-N 912 (3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanamido]propanamido]-6-methylheptanoic acid::CHEMBL296588::Iva-Val-Val-Sta-Ala-Sta-OH::N-[(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl]-4-amino-3-hydroxy-6-methylheptanoic acid::PEPSTATIN::Pepstatine::US9115083, Pepstatin Cathepsin D Bos taurus 28 ChEMBL 10.1021/jm00160a048 10.7270/Q25X29G7 3531517 Thaisrivongs, S; Pals, DT; Kati, WM; Turner, SR; Thomasco, LM; Watt, W TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=912&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 1IZE,1LS5,1M43,1SME,1W6I,1XDH,2H6T,2QZX,3EMY 5478883 8030793 CHEMBL296588 C03834 ZINC38148052 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 51031027 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1 FAXGPCHRFPCXOO-LXTPJMTPSA-N 912 (3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanamido]propanamido]-6-methylheptanoic acid::CHEMBL296588::Iva-Val-Val-Sta-Ala-Sta-OH::N-[(3-Methyl-1-oxobutyl)-L-valyl-L-valyl-4-amino-3-hydroxy-6-methylheptanoyl-L-alanyl]-4-amino-3-hydroxy-6-methylheptanoic acid::PEPSTATIN::Pepstatine::US9115083, Pepstatin Cathepsin D Bos taurus 28 ChEMBL 10.1021/jm00160a049 10.7270/Q2251JRT 3531518 Thaisrivongs, S; Pals, DT; Harris, DW; Kati, WM; Turner, SR TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=912&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 1IZE,1LS5,1M43,1SME,1W6I,1XDH,2H6T,2QZX,3EMY 5478883 8030793 CHEMBL296588 C03834 ZINC38148052 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50031545 CC[C@H](C)[C@H](NC(=O)C(F)(F)C(=O)C(CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 InChI=1S/C40H54F2N8O7/c1-8-25(4)32(36(54)45-22-27-16-12-13-17-44-27)50-37(55)40(41,42)33(51)29(18-24(2)3)47-35(53)31(20-28-21-43-23-46-28)48-34(52)30(19-26-14-10-9-11-15-26)49-38(56)57-39(5,6)7/h9-17,21,23-25,29-32H,8,18-20,22H2,1-7H3,(H,43,46)(H,45,54)(H,47,53)(H,48,52)(H,49,56)(H,50,55)/t25-,29?,30-,31-,32-/m0/s1 YJEITIRWMUEULI-WNTFFZHHSA-N 50022510 Boc-Phe-His-Leu-CF3-Ile-Amp::CHEMBL154795 Cathepsin D Bos taurus 1.7 3.2 ChEMBL 10.1021/jm00398a022 10.7270/Q2B85742 3126296 Maibaum, J; Rich, DH University of Wisconsin http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022510&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44371838 103933107 CHEMBL154795 ZINC95605969 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50030057 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C InChI=1S/C26H50N4O5/c1-15(2)10-11-27-25(34)19(9)28-23(33)14-21(31)20(12-16(3)4)29-26(35)24(18(7)8)30-22(32)13-17(5)6/h15-21,24,31H,10-14H2,1-9H3,(H,27,34)(H,28,33)(H,29,35)(H,30,32)/t19-,20+,21+,24-/m0/s1 JQOFUZAKCVQZTH-BLRYILKCSA-N 50226133 CHEMBL3392088 Cathepsin D Bos taurus 1400 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50226133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50226133&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725164 378166649 CHEMBL3392088 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50030058 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C InChI=1S/C29H48N4O6/c1-18(2)14-15-30-26(36)20(5)31-24(35)17-23(34)22(16-21-12-10-9-11-13-21)32-27(37)25(19(3)4)33-28(38)39-29(6,7)8/h9-13,18-20,22-23,25,34H,14-17H2,1-8H3,(H,30,36)(H,31,35)(H,32,37)(H,33,38)/t20-,22+,23-,25-/m0/s1 KAVIURCQYOJSCT-APWUFGDNSA-N 50226136 CHEMBL3392081 Cathepsin D Bos taurus 4860 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50226136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50226136&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725157 378166652 CHEMBL3392081 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50612144 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C32H61N5O6/c1-18(2)14-15-33-28(39)23(10)34-25(38)17-22(9)24(16-19(3)4)35-29(40)26(20(5)6)36-30(41)27(21(7)8)37-31(42)43-32(11,12)13/h18-24,26-27H,14-17H2,1-13H3,(H,33,39)(H,34,38)(H,35,40)(H,36,41)(H,37,42)/t22-,23?,24?,26?,27-/m1/s1 XHAGYXYLFCHAMX-JEQIRWFESA-N 50025539 CHEMBL3392082::{2-Methyl-1-[2-methyl-1-(3-methyl-1-{1-methyl-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-butylcarbamoyl)-propylcarbamoyl]-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 31 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025539 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025539&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725158 103935413 CHEMBL3392082CHEMBL316414 ZINC36295256 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50612145 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C InChI=1S/C26H50N4O5/c1-15(2)10-11-27-25(34)19(9)28-23(33)14-21(31)20(12-16(3)4)29-26(35)24(18(7)8)30-22(32)13-17(5)6/h15-21,24,31H,10-14H2,1-9H3,(H,27,34)(H,28,33)(H,29,35)(H,30,32)/t19-,20+,21-,24-/m0/s1 JQOFUZAKCVQZTH-XARGGIHNSA-N 50226132 CHEMBL3392091 Cathepsin D Bos taurus 2100 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50226132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50226132&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725167 378166648 CHEMBL3392091 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50612146 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C31H59N5O7/c1-17(2)13-14-32-27(39)21(9)33-24(38)16-23(37)22(15-18(3)4)34-28(40)25(19(5)6)35-29(41)26(20(7)8)36-30(42)43-31(10,11)12/h17-23,25-26,37H,13-16H2,1-12H3,(H,32,39)(H,33,38)(H,34,40)(H,35,41)(H,36,42)/t21-,22+,23+,25-,26-/m0/s1 GQYQVRLKCQSBAG-GDKKAJJHSA-N 50226134 CHEMBL3392083 Cathepsin D Bos taurus 445 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50226134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50226134&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725159 378166650 CHEMBL3392083 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50612147 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](C)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C InChI=1S/C32H61N5O6/c1-18(2)14-15-33-28(39)23(10)34-25(38)17-22(9)24(16-19(3)4)35-29(40)26(20(5)6)36-30(41)27(21(7)8)37-31(42)43-32(11,12)13/h18-24,26-27H,14-17H2,1-13H3,(H,33,39)(H,34,38)(H,35,40)(H,36,41)(H,37,42)/t22-,23?,24?,26?,27+/m0/s1 XHAGYXYLFCHAMX-AEHWDRQNSA-N 50025512 CHEMBL3392094::{2-Methyl-1-[2-methyl-1-(3-methyl-1-{1-methyl-2-[1-(3-methyl-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-butylcarbamoyl)-propylcarbamoyl]-propyl}-carbamic acid tert-butyl ester Cathepsin D Bos taurus 620 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50025512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50025512&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725170 103935386 CHEMBL3392094CHEMBL84744 ZINC36295225 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50612148 CC(C)CCNC(=O)[C@H](C)NC(=O)C[C@H](O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C InChI=1S/C31H59N5O6/c1-17(2)12-13-32-29(40)22(11)33-26(39)16-24(37)23(14-18(3)4)34-30(41)28(21(9)10)36-31(42)27(20(7)8)35-25(38)15-19(5)6/h17-24,27-28,37H,12-16H2,1-11H3,(H,32,40)(H,33,39)(H,34,41)(H,35,38)(H,36,42)/t22-,23+,24-,27-,28-/m0/s1 JTZSUTRATHTTMW-DWFKVPPKSA-N 50226135 CHEMBL3392084 Cathepsin D Bos taurus >100 ChEMBL 10.1021/jm00162a015 10.7270/Q2NZ887N 3783611 Agarwal, NS; Rich, DH TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50226135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50226135&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 118725160 378166651 CHEMBL3392084 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033858 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26+,27?,28+/m0/s1 IEWAGORIVPFRDB-FBHWMOSWSA-N 50012246 CHEMBL58153::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus 36.0 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012246&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300955 103924540 CHEMBL58153 ZINC29565616 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50033862 COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@H](O)CC(C)C InChI=1S/C31H50N4O9S/c1-21(2)18-26(36)28(37)24(19-22-10-6-4-7-11-22)32-30(39)27(31(40)43-3)33-29(38)25(20-23-12-8-5-9-13-23)34-45(41,42)35-14-16-44-17-15-35/h5,8-9,12-13,21-22,24-28,34,36-37H,4,6-7,10-11,14-20H2,1-3H3,(H,32,39)(H,33,38)/t24-,25-,26+,27?,28+/m0/s1 IEWAGORIVPFRDB-FBHWMOSWSA-N 50012246 CHEMBL58153::N-(1-Cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexyl)-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester Cathepsin D Bos taurus 36 ChEMBL 10.1021/jm00111a002 10.7270/Q2NG4R73 2066966 Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Warner-Lambert Company http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012246&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 44300955 103924540 CHEMBL58153 ZINC29565616 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27 50627962 CC(C)OC(=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](CC(=O)N1CCOCC1)Cc1cccc2ccccc12 InChI=1S/C38H51N5O7/c1-25(2)50-38(48)35(45)32(19-26-9-4-3-5-10-26)41-37(47)33(22-30-23-39-24-40-30)42-36(46)29(21-34(44)43-15-17-49-18-16-43)20-28-13-8-12-27-11-6-7-14-31(27)28/h6-8,11-14,23-26,29,32-33,35,45H,3-5,9-10,15-22H2,1-2H3,(H,39,40)(H,41,47)(H,42,46)/t29-,32-,33-,35?/m1/s1 NQXSBCTYTMQGGJ-PSPBILMESA-N 50012951 4-Cyclohexyl-2-hydroxy-3-[3-(1H-imidazol-4-yl)-2-(4-morpholin-4-yl-2-naphthalen-1-ylmethyl-4-oxo-butyrylamino)-propionylamino]-butyric acid isopropyl ester::CHEMBL3350322 Cathepsin D Bos taurus 80000 ChEMBL 10.1021/jm00172a005 10.7270/Q2N29XJZ 2120440 Iizuka, K; Kamijo, T; Harada, H; Akahane, K; Kubota, T; Umeyama, H; Ishida, T; Kiso, Y Kissei Pharmaceutical Company Ltd http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50012951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50002688&target=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50012951&enzyme=Cathepsin+D&column=ki&startPg=0&Increment=50&submit=Search 6918046 103925201 CHEMBL3350322CHEMBL91826 C00615 ZINC26645037 1 VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL Cathepsin D CATD_BOVIN P80209 Q9TS27