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 399447 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)c2ccccc2)Cc2cccnc12 InChI=1S/C24H31N5O3/c1-15(2)20(28-22(30)16(3)25-4)24(32)29-19(13-18-11-8-12-26-21(18)29)14-27-23(31)17-9-6-5-7-10-17/h5-12,15-16,19-20,25H,13-14H2,1-4H3,(H,27,31)(H,28,30)/t16-,19-,20-/m0/s1 RJWKBXICIIIARA-VDGAXYAQSA-N 228590 US9340573, 1 E3 ubiquitin-protein ligase XIAP [124-240] 0.888 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228590&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 76902766 336948112 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399448 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(C)=O)Cc2cccnc12 InChI=1S/C19H29N5O3/c1-11(2)16(23-18(26)12(3)20-5)19(27)24-15(10-22-13(4)25)9-14-7-6-8-21-17(14)24/h6-8,11-12,15-16,20H,9-10H2,1-5H3,(H,22,25)(H,23,26)/t12-,15-,16-/m0/s1 SHSNGKZXZBGSLA-RCBQFDQVSA-N 228591 US9340573, 2 E3 ubiquitin-protein ligase XIAP [124-240] 4.665 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228591&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 117888130 336948113 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399449 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)NC)Cc2cccnc12 InChI=1S/C19H30N6O3/c1-11(2)15(24-17(26)12(3)20-4)18(27)25-14(10-23-19(28)21-5)9-13-7-6-8-22-16(13)25/h6-8,11-12,14-15,20H,9-10H2,1-5H3,(H,24,26)(H2,21,23,28)/t12-,14-,15-/m0/s1 DNDOKHQQWLFLBD-QEJZJMRPSA-N 228592 US9340573, 3 E3 ubiquitin-protein ligase XIAP [124-240] 4.875 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228592&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 117888137 336948114 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399450 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)Cc2ccccc2)Cc2cccnc12 InChI=1S/C25H33N5O3/c1-16(2)22(29-24(32)17(3)26-4)25(33)30-20(14-19-11-8-12-27-23(19)30)15-28-21(31)13-18-9-6-5-7-10-18/h5-12,16-17,20,22,26H,13-15H2,1-4H3,(H,28,31)(H,29,32)/t17-,20-,22-/m0/s1 XFVQREUYFZAMJL-XJABCFGWSA-N 228593 US9340573, 4 E3 ubiquitin-protein ligase XIAP [124-240] 1.57 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228593&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777099 336948115 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399451 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)OC)Cc2cccnc12 InChI=1S/C19H29N5O4/c1-11(2)15(23-17(25)12(3)20-4)18(26)24-14(10-22-19(27)28-5)9-13-7-6-8-21-16(13)24/h6-8,11-12,14-15,20H,9-10H2,1-5H3,(H,22,27)(H,23,25)/t12-,14-,15-/m0/s1 ZDWCGZXOBQMPMU-QEJZJMRPSA-N 228594 US9340573, 5 E3 ubiquitin-protein ligase XIAP [124-240] 1.669 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228594&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777124 336948116 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399452 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)N(C)C)Cc2cccnc12 InChI=1S/C20H32N6O3/c1-12(2)16(24-18(27)13(3)21-4)19(28)26-15(11-23-20(29)25(5)6)10-14-8-7-9-22-17(14)26/h7-9,12-13,15-16,21H,10-11H2,1-6H3,(H,23,29)(H,24,27)/t13-,15-,16-/m0/s1 WZRSIBRMVURXEQ-BPUTZDHNSA-N 228595 US9340573, 6 E3 ubiquitin-protein ligase XIAP [124-240] 6.167 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228595&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777101 336948117 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399453 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)Nc2ccccc2)Cc2cccnc12 InChI=1S/C24H32N6O3/c1-15(2)20(29-22(31)16(3)25-4)23(32)30-19(13-17-9-8-12-26-21(17)30)14-27-24(33)28-18-10-6-5-7-11-18/h5-12,15-16,19-20,25H,13-14H2,1-4H3,(H,29,31)(H2,27,28,33)/t16-,19-,20-/m0/s1 QTCYNUCDNBZLFI-VDGAXYAQSA-N 228596 US9340573, 7 E3 ubiquitin-protein ligase XIAP [124-240] 1.544 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228596 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228596&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777103 336948118 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399454 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)[C@@H](C)c2ccccc2)Cc2cccnc12 InChI=1S/C26H35N5O3/c1-16(2)22(30-25(33)18(4)27-5)26(34)31-21(14-20-12-9-13-28-23(20)31)15-29-24(32)17(3)19-10-7-6-8-11-19/h6-13,16-18,21-22,27H,14-15H2,1-5H3,(H,29,32)(H,30,33)/t17-,18-,21-,22-/m0/s1 HAXZTIUXLDHRTE-GPHNJDIKSA-N 228597 US9340573, 8 E3 ubiquitin-protein ligase XIAP [124-240] 2.561 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228597&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 127053762 336948119 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399455 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNS(C)(=O)=O)Cc2cccnc12 InChI=1S/C18H29N5O4S/c1-11(2)15(22-17(24)12(3)19-4)18(25)23-14(10-21-28(5,26)27)9-13-7-6-8-20-16(13)23/h6-8,11-12,14-15,19,21H,9-10H2,1-5H3,(H,22,24)/t12-,14-,15-/m0/s1 AQPFZOROSFELID-QEJZJMRPSA-N 228598 US9340573, 9 E3 ubiquitin-protein ligase XIAP [124-240] 1.236 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228598 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228598&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777107 336948120 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399456 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNS(=O)(=O)c2ccccc2)Cc2cccnc12 InChI=1S/C23H31N5O4S/c1-15(2)20(27-22(29)16(3)24-4)23(30)28-18(13-17-9-8-12-25-21(17)28)14-26-33(31,32)19-10-6-5-7-11-19/h5-12,15-16,18,20,24,26H,13-14H2,1-4H3,(H,27,29)/t16-,18-,20-/m0/s1 YEKKUTCQUXWIQW-QRFRQXIXSA-N 228599 US9340573, 10 E3 ubiquitin-protein ligase XIAP [124-240] 0.82 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228599&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777109 336948121 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399457 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)OCc2ccccc2)Cc2cccnc12 InChI=1S/C25H33N5O4/c1-16(2)21(29-23(31)17(3)26-4)24(32)30-20(13-19-11-8-12-27-22(19)30)14-28-25(33)34-15-18-9-6-5-7-10-18/h5-12,16-17,20-21,26H,13-15H2,1-4H3,(H,28,33)(H,29,31)/t17-,20-,21-/m0/s1 CRHVURUHLHTXLH-YYWHXJBOSA-N 228600 US9340573, 11 E3 ubiquitin-protein ligase XIAP [124-240] 1.047 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228600 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228600&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 117888639 336948122 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399458 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNC(=O)Oc2ccccc2)Cc2cccnc12 InChI=1S/C24H31N5O4/c1-15(2)20(28-22(30)16(3)25-4)23(31)29-18(13-17-9-8-12-26-21(17)29)14-27-24(32)33-19-10-6-5-7-11-19/h5-12,15-16,18,20,25H,13-14H2,1-4H3,(H,27,32)(H,28,30)/t16-,18-,20-/m0/s1 YETRPNDFXWHVDD-QRFRQXIXSA-N 228601 US9340573, 12 E3 ubiquitin-protein ligase XIAP [124-240] 1.622 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228601 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228601&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777126 336948123 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399459 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNc2ccccc2)Cc2cccnc12 InChI=1S/C23H31N5O2/c1-15(2)20(27-22(29)16(3)24-4)23(30)28-19(13-17-9-8-12-25-21(17)28)14-26-18-10-6-5-7-11-18/h5-12,15-16,19-20,24,26H,13-14H2,1-4H3,(H,27,29)/t16-,19-,20-/m0/s1 YLJJBQDWLZEISQ-VDGAXYAQSA-N 228602 US9340573, 13 E3 ubiquitin-protein ligase XIAP [124-240] 0.307 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228602 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228602&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73443116 336948124 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 399460 CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1[C@H](CNc2ccc3ccccc3c2)Cc2cccnc12 InChI=1S/C27H33N5O2/c1-17(2)24(31-26(33)18(3)28-4)27(34)32-23(15-21-10-7-13-29-25(21)32)16-30-22-12-11-19-8-5-6-9-20(19)14-22/h5-14,17-18,23-24,28,30H,15-16H2,1-4H3,(H,31,33)/t18-,23-,24-/m0/s1 JYRTVNMQRJKWEK-NWVWQQAFSA-N 228603 US9340573, 14 E3 ubiquitin-protein ligase XIAP [124-240] 0.506 7.5 37.00 C US Patent 10.7270/Q2FJ2FNT aid1802818 US9340573 Hogg, JH; Lou, Y Hoffmann-La Roche Inc http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=228603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=9785&target=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=228603&enzyme=E3+ubiquitin-protein+ligase+XIAP+%5B124-240%5D&column=ki&startPg=0&Increment=50&submit=Search 73777128 336948125 1 MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHEPNCFFVLGRNLNIRSE E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14