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 PubChem SID 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 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 600013 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2ccccc2F)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H80FN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)70-34-43-21-13-12-20-42(43)31-50(70)57(76)69(38(3)45-23-16-17-25-47(45)62)33-39-27-29-41(30-28-39)55(74)65-44-32-49(56(75)66-48-26-18-22-40-19-14-15-24-46(40)48)71(35-44)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-17,19-21,23-25,27-30,36-38,44,48-52,63-64H,18,22,26,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38+,44-,48+,49-,50-,51+,52+/m0/s1 SUVGZSPIXFUCLS-NQFXVQPCSA-N 50030268 CHEMBL3339221::US9603889, Example 1 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 90.0 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50030268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50030268&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603510 313065764 CHEMBL3339221 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600015 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN(CCc2ccccc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H81N9O7/c1-38(62-9)53(71)66-51(60(3,4)5)58(76)69-36-45-23-15-14-22-44(45)33-50(69)57(75)68(32-31-40-19-12-11-13-20-40)35-41-27-29-43(30-28-41)55(73)64-46-34-49(56(74)65-48-26-18-24-42-21-16-17-25-47(42)48)70(37-46)59(77)52(61(6,7)8)67-54(72)39(2)63-10/h11-17,19-23,25,27-30,38-39,46,48-52,62-63H,18,24,26,31-37H2,1-10H3,(H,64,73)(H,65,74)(H,66,71)(H,67,72)/t38-,39-,46?,48+,49-,50-,51+,52+/m0/s1 WBECJJFGDUGEEK-NPDPEGIPSA-N 312090 US9603889, Example 2 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 850 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312090&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 126725456 383539076 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600017 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2cccc(OC)c2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C62H83N9O8/c1-37(63-10)54(72)67-52(61(4,5)6)59(77)70-35-45-21-14-13-20-44(45)32-51(70)58(76)69(39(3)43-23-17-24-47(31-43)79-12)34-40-27-29-42(30-28-40)56(74)65-46-33-50(57(75)66-49-26-18-22-41-19-15-16-25-48(41)49)71(36-46)60(78)53(62(7,8)9)68-55(73)38(2)64-11/h13-17,19-21,23-25,27-31,37-39,46,49-53,63-64H,18,22,26,32-36H2,1-12H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t37-,38-,39+,46?,49+,50-,51-,52+,53+/m0/s1 MCROMBFXBQBUQE-MSMLPYSUSA-N 312091 US9603889, Example 3 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 120 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312091&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106615 383539077 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600019 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2ccc(F)cc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H80FN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)70-34-44-19-13-12-18-43(44)31-50(70)57(76)69(38(3)40-27-29-45(62)30-28-40)33-39-23-25-42(26-24-39)55(74)65-46-32-49(56(75)66-48-22-16-20-41-17-14-15-21-47(41)48)71(35-46)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-15,17-19,21,23-30,36-38,46,48-52,63-64H,16,20,22,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38+,46-,48+,49-,50-,51+,52+/m0/s1 VIZNQQUAZMRASA-DNDJARQFSA-N 312092 US9603889, Example 4 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 180 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312092&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603551 383539078 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600021 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2ccccc2Cl)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H80ClN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)70-34-43-21-13-12-20-42(43)31-50(70)57(76)69(38(3)45-23-16-17-25-47(45)62)33-39-27-29-41(30-28-39)55(74)65-44-32-49(56(75)66-48-26-18-22-40-19-14-15-24-46(40)48)71(35-44)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-17,19-21,23-25,27-30,36-38,44,48-52,63-64H,18,22,26,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38+,44-,48+,49-,50-,51+,52+/m0/s1 JUQLTUQEOXZVES-NQFXVQPCSA-N 312093 US9603889, Example 5 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 300 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312093&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603595 383539079 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600023 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2cccc(F)c2F)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H79F2N9O7/c1-35(64-10)53(73)68-51(60(4,5)6)58(78)71-33-42-20-13-12-19-41(42)30-49(71)57(77)70(37(3)44-23-17-24-46(62)50(44)63)32-38-26-28-40(29-27-38)55(75)66-43-31-48(56(76)67-47-25-16-21-39-18-14-15-22-45(39)47)72(34-43)59(79)52(61(7,8)9)69-54(74)36(2)65-11/h12-15,17-20,22-24,26-29,35-37,43,47-49,51-52,64-65H,16,21,25,30-34H2,1-11H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t35-,36-,37+,43-,47+,48-,49-,51+,52+/m0/s1 XKVHXUXRQUCUTL-ZJDZNGFLSA-N 312094 US9603889, Example 6 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 150 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312094&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603596 383539080 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600025 CCC[C@@H](N(Cc1ccc(cc1)C(=O)N[C@H]1C[C@H](N(C1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)c1ccccc1 InChI=1S/C63H85N9O7/c1-12-21-50(43-23-14-13-15-24-43)70(59(77)52-34-45-25-16-17-26-46(45)37-71(52)60(78)53(62(4,5)6)68-55(73)39(2)64-10)36-41-30-32-44(33-31-41)57(75)66-47-35-51(58(76)67-49-29-20-27-42-22-18-19-28-48(42)49)72(38-47)61(79)54(63(7,8)9)69-56(74)40(3)65-11/h13-19,22-26,28,30-33,39-40,47,49-54,64-65H,12,20-21,27,29,34-38H2,1-11H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t39-,40-,47-,49+,50+,51-,52-,53+,54+/m0/s1 CXWIRGMWNKKYDO-HRRNLFNOSA-N 312095 US9603889, Example 7 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1140 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312095&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603640 383539081 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600027 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CN([C@@H](COC)c2ccccc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C62H83N9O8/c1-38(63-9)54(72)67-52(61(3,4)5)59(77)70-35-45-24-16-15-23-44(45)32-50(70)58(76)69(51(37-79-11)42-21-13-12-14-22-42)34-40-28-30-43(31-29-40)56(74)65-46-33-49(57(75)66-48-27-19-25-41-20-17-18-26-47(41)48)71(36-46)60(78)53(62(6,7)8)68-55(73)39(2)64-10/h12-18,20-24,26,28-31,38-39,46,48-53,63-64H,19,25,27,32-37H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t38-,39-,46-,48+,49-,50-,51-,52+,53+/m0/s1 XZWQAFLMOTZHHO-DFNGJWONSA-N 50030266 CHEMBL3339223::US9603889, Example 8 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 30.0 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50030266 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50030266&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603641 313065762 CHEMBL3339223 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600029 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)n1ccc2cc(CN([C@@H](COC)c3ccccc3)C(=O)[C@@H]3Cc4ccccc4CN3C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)ccc12)C(C)(C)C InChI=1S/C64H84N10O8/c1-39(65-9)56(75)69-54(63(3,4)5)60(79)73-36-46-24-16-15-23-44(46)33-52(73)59(78)72(53(38-82-11)43-21-13-12-14-22-43)35-41-28-29-50-45(32-41)30-31-71(50)62(81)67-47-34-51(58(77)68-49-27-19-25-42-20-17-18-26-48(42)49)74(37-47)61(80)55(64(6,7)8)70-57(76)40(2)66-10/h12-18,20-24,26,28-32,39-40,47,49,51-55,65-66H,19,25,27,33-38H2,1-11H3,(H,67,81)(H,68,77)(H,69,75)(H,70,76)/t39-,40-,47-,49+,51-,52-,53-,54+,55+/m0/s1 OYWRLKDYLPPCDX-DKCQCBDISA-N 312097 US9603889, Example 9 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 340 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312097&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118323245 383539083 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600031 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(CCc1ccccc1)C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(C)(C)C InChI=1S/C61H81N9O7/c1-38(62-9)53(71)66-51(60(3,4)5)58(76)69-35-45-23-15-14-22-44(45)33-47(69)37-68(32-31-40-19-12-11-13-20-40)57(75)43-29-27-42(28-30-43)55(73)64-46-34-50(56(74)65-49-26-18-24-41-21-16-17-25-48(41)49)70(36-46)59(77)52(61(6,7)8)67-54(72)39(2)63-10/h11-17,19-23,25,27-30,38-39,46-47,49-52,62-63H,18,24,26,31-37H2,1-10H3,(H,64,73)(H,65,74)(H,66,71)(H,67,72)/t38-,39-,46-,47-,49+,50-,51+,52+/m0/s1 OXYMRWGLDAHNRS-PIJVGMIXSA-N 312099 US9603889, Example 10 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 410 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312099&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73603685 383539085 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600033 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(Cc2cccc(Cl)c2Cl)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C60H77Cl2N9O7/c1-35(63-9)52(72)67-50(59(3,4)5)57(77)70-33-41-19-12-11-18-40(41)29-48(70)56(76)69(32-42-21-15-23-45(61)49(42)62)31-37-25-27-39(28-26-37)54(74)65-43-30-47(55(75)66-46-24-16-20-38-17-13-14-22-44(38)46)71(34-43)58(78)51(60(6,7)8)68-53(73)36(2)64-10/h11-15,17-19,21-23,25-28,35-36,43,46-48,50-51,63-64H,16,20,24,29-34H2,1-10H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t35-,36-,43?,46?,47-,48-,50+,51+/m0/s1 UFRZPIWCZFNHSK-ASCDQIFNSA-N 312100 (S)-N-(2,3- Dichlorobenzyl)-2- ((S)-3,3-dimethyl-2- ((S)-2- (methylamino) propanamido) butanoyl)- N-(4-(((3S,5S)- 1-((S)-3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- 1,2,3,4-tetra- hydroisoquinoline- 3-carboxamide::US9603889, Example 11 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 510 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312100&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106617 383539086 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600035 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(CCc2ccc3ccccc3c2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C65H83N9O7/c1-40(66-9)57(75)70-55(64(3,4)5)62(80)73-38-49-22-14-13-21-48(49)35-54(73)61(79)72(33-32-42-26-29-44-18-11-12-20-47(44)34-42)37-43-27-30-46(31-28-43)59(77)68-50-36-53(60(78)69-52-25-17-23-45-19-15-16-24-51(45)52)74(39-50)63(81)56(65(6,7)8)71-58(76)41(2)67-10/h11-16,18-22,24,26-31,34,40-41,50,52-56,66-67H,17,23,25,32-33,35-39H2,1-10H3,(H,68,77)(H,69,78)(H,70,75)(H,71,76)/t40-,41-,50?,52?,53-,54-,55+,56+/m0/s1 WFUUBVXJSSGEKN-SZKORNPESA-N 312101 (S)-2-((S)-3,3- Dimethyl-2- ((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2- ((S)-2-(methyl- amino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-(2-(naphthalen- 2-yl)ethyl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 12 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1300 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312101&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106618 383539087 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600037 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(Cc2ccccc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)C(NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C60H79N9O7/c1-37(61-9)52(70)65-50(59(3,4)5)57(75)68-35-44-23-15-14-22-43(44)31-49(68)56(74)67(33-39-19-12-11-13-20-39)34-40-27-29-42(30-28-40)54(72)63-45-32-48(55(73)64-47-26-18-24-41-21-16-17-25-46(41)47)69(36-45)58(76)51(60(6,7)8)66-53(71)38(2)62-10/h11-17,19-23,25,27-30,37-38,45,47-51,61-62H,18,24,26,31-36H2,1-10H3,(H,63,72)(H,64,73)(H,65,70)(H,66,71)/t37-,38-,45?,47?,48-,49-,50?,51+/m0/s1 SCYPULPKNVKNQH-NJPRNJCPSA-N 312102 (S)-N-Benzyl-2- ((S)-3,3- dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2- ((S)- 2-(methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- 1,2,3,4-tetra- hydroisoquinoline- 3-carboxamide::US9603889, Example 13 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 600 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312102&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106619 383539088 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600039 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(Cc2ccc3ccccc3c2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C64H81N9O7/c1-39(65-9)56(74)69-54(63(3,4)5)61(79)72-37-48-22-14-13-21-47(48)33-53(72)60(78)71(36-42-28-29-43-18-11-12-20-46(43)32-42)35-41-26-30-45(31-27-41)58(76)67-49-34-52(59(77)68-51-25-17-23-44-19-15-16-24-50(44)51)73(38-49)62(80)55(64(6,7)8)70-57(75)40(2)66-10/h11-16,18-22,24,26-32,39-40,49,51-55,65-66H,17,23,25,33-38H2,1-10H3,(H,67,76)(H,68,77)(H,69,74)(H,70,75)/t39-,40-,49?,51?,52-,53-,54+,55+/m0/s1 RQSQGPVQOJIACV-APJIPKEOSA-N 312103 (S)-2-((S)- 3,3-Dimethyl- 2-((S)-2-(methyl- amino) propanamido) butanoyl)-N- (4-(((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen-1- yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-(naphthalen-2- ylmethyl)-1,2,3,4- tetrahydro- isoquinoline-3- carboxamide::US9603889, Example 14 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1720 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312103&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106620 383539089 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600041 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2ccc3ccccc3c2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C65H83N9O7/c1-39(66-10)57(75)70-55(64(4,5)6)62(80)73-37-49-23-15-14-22-48(49)34-54(73)61(79)72(41(3)46-32-31-43-19-12-13-21-47(43)33-46)36-42-27-29-45(30-28-42)59(77)68-50-35-53(60(78)69-52-26-18-24-44-20-16-17-25-51(44)52)74(38-50)63(81)56(65(7,8)9)71-58(76)40(2)67-11/h12-17,19-23,25,27-33,39-41,50,52-56,66-67H,18,24,26,34-38H2,1-11H3,(H,68,77)(H,69,78)(H,70,75)(H,71,76)/t39-,40-,41+,50?,52?,53-,54-,55+,56+/m0/s1 HGRBQHLSCJMBBG-ZTKZYTAPSA-N 312104 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-((R)-1- (naphthalen- 2-yl)ethyl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 15 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 330 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312104 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312104&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106621 383539090 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600043 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(CCc2ccccc2)C(=O)[C@H]2N(CCc3ccccc23)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H81N9O7/c1-38(62-9)53(71)66-51(60(3,4)5)58(76)69-34-32-43-22-15-17-25-47(43)50(69)57(75)68(33-31-40-19-12-11-13-20-40)36-41-27-29-44(30-28-41)55(73)64-45-35-49(56(74)65-48-26-18-23-42-21-14-16-24-46(42)48)70(37-45)59(77)52(61(6,7)8)67-54(72)39(2)63-10/h11-17,19-22,24-25,27-30,38-39,45,48-52,62-63H,18,23,26,31-37H2,1-10H3,(H,64,73)(H,65,74)(H,66,71)(H,67,72)/t38-,39-,45?,48?,49-,50-,51+,52+/m0/s1 VPPOJCROUNMKKO-QOULSCCGSA-N 312105 (S)-2-((S)-3,3- Dimethyl- 2-((S)-2-(methyl- amino) propanamido) butanoyl)-N-(4- ((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen-1- yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-phenethyl- 1,2,3,4-tetrahydro- isoquinoline- 1-carboxamide::US9603889, Example 16 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1600 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312105 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312105&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106622 383539091 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600045 CN[C@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@H](C)Cc1ccccc1F)C(C)(C)C InChI=1S/C62H82FN9O7/c1-37(31-44-21-15-17-25-49(44)63)70(36-47-32-43-20-12-13-22-45(43)34-71(47)59(78)52(61(4,5)6)68-54(73)38(2)64-10)58(77)42-29-27-41(28-30-42)56(75)66-46-33-51(57(76)67-50-26-18-23-40-19-14-16-24-48(40)50)72(35-46)60(79)53(62(7,8)9)69-55(74)39(3)65-11/h12-17,19-22,24-25,27-30,37-39,46-47,50-53,64-65H,18,23,26,31-36H2,1-11H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t37-,38+,39-,46+,47+,50-,51+,52-,53-/m1/s1 QCAMDWZORZRYMM-XRTXGEDASA-N 312106 N1-(((S)-2-((S)- 3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 1,2,3,4-tetra- hydroisoquinolin- 3-yl)methyl)- N4-((3S,5S)-1- ((S)-3,3-dimethyl- 2-((S)-2-(methyl- amino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)-N1- ((R)-1-(2- fluorophenyl) propan-2-yl) terephthalamide::US9603889, Example 17 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 590 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312106&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330703 383539092 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600047 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)c2cccc(Cl)c2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H80ClN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)70-34-44-20-13-12-19-43(44)31-50(70)57(76)69(38(3)42-22-16-23-45(62)30-42)33-39-26-28-41(29-27-39)55(74)65-46-32-49(56(75)66-48-25-17-21-40-18-14-15-24-47(40)48)71(35-46)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-16,18-20,22-24,26-30,36-38,46,48-52,63-64H,17,21,25,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38?,46?,48?,49-,50-,51+,52+/m0/s1 HQFKHRXXASCMRM-PJYHSPRCSA-N 312107 (S)-N-((S)-1-(3- Chlorophenyl) ethyl)-2-((S)- 3,3-dimethyl-2- ((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl) benzyl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 18 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 190 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312107 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312107&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106623 383539093 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600049 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)c2ccccc2F)C(=O)[C@H]2N(CCc3ccccc23)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H80FN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)69-32-31-41-20-13-15-24-46(41)50(69)57(76)70(38(3)44-22-16-17-25-47(44)62)34-39-27-29-42(30-28-39)55(74)65-43-33-49(56(75)66-48-26-18-21-40-19-12-14-23-45(40)48)71(35-43)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-17,19-20,22-25,27-30,36-38,43,48-52,63-64H,18,21,26,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38+,43?,48?,49-,50-,51+,52+/m0/s1 OJMRKFRVXDLLRT-ZODIYHDXSA-N 312108 (S)-2-((S)-3,3- Dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-N- (4-(((3S,5S)- 1-((S)-3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-((R)-1-(2- fluorophenyl) ethyl)-1,2,3,4- tetrahydro- isoquinoline- 1-carboxamide::US9603889, Example 19 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1870 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312108 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312108&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106624 383539094 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600051 CCC(N(Cc1ccc(cc1)C(=O)NC1C[C@H](N(C1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)c1ccccc1 InChI=1S/C62H83N9O7/c1-12-49(42-22-14-13-15-23-42)69(58(76)51-33-44-24-16-17-25-45(44)36-70(51)59(77)52(61(4,5)6)67-54(72)38(2)63-10)35-40-29-31-43(32-30-40)56(74)65-46-34-50(57(75)66-48-28-20-26-41-21-18-19-27-47(41)48)71(37-46)60(78)53(62(7,8)9)68-55(73)39(3)64-11/h13-19,21-25,27,29-32,38-39,46,48-53,63-64H,12,20,26,28,33-37H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t38-,39-,46?,48?,49?,50-,51-,52+,53+/m0/s1 CWBSLRMZMMYANP-FSSCPAOLSA-N 312109 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen-1- yl)carbamoyl) pyrrolidin- 3-yl)carbamoyl) benzyl)-N-((R)- 1-phenylpropyl)- 1,2,3,4-tetra- hydroisoquinoline- 3-carboxamide::US9603889, Example 20 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 320 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312109 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312109&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106625 383539095 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600053 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)C(c2ccccc2)c2ccccc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C68H87N9O7/c1-42(69-10)60(78)73-58(67(4,5)6)65(83)76-40-51-29-19-18-28-50(51)37-56(76)64(82)75(44(3)57(47-24-14-12-15-25-47)48-26-16-13-17-27-48)39-45-33-35-49(36-34-45)62(80)71-52-38-55(63(81)72-54-32-22-30-46-23-20-21-31-53(46)54)77(41-52)66(84)59(68(7,8)9)74-61(79)43(2)70-11/h12-21,23-29,31,33-36,42-44,52,54-59,69-70H,22,30,32,37-41H2,1-11H3,(H,71,80)(H,72,81)(H,73,78)(H,74,79)/t42-,43-,44?,52?,54?,55-,56-,58+,59+/m0/s1 CYHTUCVQCYTOFX-LRGHKLHQSA-N 312110 (S)-2-((S)-3,3- Dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)- 1-((S)-3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-5- (((R)-1,2,3,4-tetra- hydronaphthalen- 1-yl)carbamoyl) pyrrolidin- 3-yl)carbamoyl) benzyl)-N-((R)- 1,1-diphenylpropan- 2-yl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 21 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2830 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312110 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312110&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106626 383539096 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600055 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C2CCCc3ccccc23)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C63H83N9O7/c1-38(64-9)55(73)68-53(62(3,4)5)60(78)71-36-45-22-12-11-21-44(45)33-52(71)59(77)70(50-28-18-24-42-20-14-16-26-48(42)50)35-40-29-31-43(32-30-40)57(75)66-46-34-51(58(76)67-49-27-17-23-41-19-13-15-25-47(41)49)72(37-46)61(79)54(63(6,7)8)69-56(74)39(2)65-10/h11-16,19-22,25-26,29-32,38-39,46,49-54,64-65H,17-18,23-24,27-28,33-37H2,1-10H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t38-,39-,46?,49?,50?,51-,52-,53+,54+/m0/s1 LDVMHSURAWAEBW-IBHSQVJQSA-N 312111 (S)-2-((S)-3,3- Dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen-1- yl)carbamoyl) pyrrolidin- 3-yl)carbamoyl) benzyl)-N-((S)- 1,2,3,4-tetrahydro- napthalen-1-yl)- 1,2,3,4- tetrahydroiso- quinoline- 3-carboxamide::US9603889, Example 22 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1010 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312111 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312111&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106627 383539097 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600057 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)c2ccccc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H81N9O7/c1-37(62-10)53(71)66-51(60(4,5)6)58(76)69-35-45-24-16-15-23-44(45)32-50(69)57(75)68(39(3)41-20-13-12-14-21-41)34-40-28-30-43(31-29-40)55(73)64-46-33-49(56(74)65-48-27-19-25-42-22-17-18-26-47(42)48)70(36-46)59(77)52(61(7,8)9)67-54(72)38(2)63-11/h12-18,20-24,26,28-31,37-39,46,48-52,62-63H,19,25,27,32-36H2,1-11H3,(H,64,73)(H,65,74)(H,66,71)(H,67,72)/t37-,38-,39?,46?,48?,49-,50-,51+,52+/m0/s1 CLXWWRLIDSQWAQ-PBDLGBDGSA-N 312112 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen-1- yl)carbamoyl) pyrrolidin-3-yl) carbamoyl) benzyl)-N- ((R)-1-phenylethyl)- 1,2,3,4-tetra- hydroisoquinoline- 3-carboxamide::US9603889, Example 23 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 170 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312112&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106628 383539098 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600059 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)c2ccccc2OC)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C62H83N9O8/c1-37(63-10)54(72)67-52(61(4,5)6)59(77)70-35-44-22-14-13-21-43(44)32-50(70)58(76)69(39(3)46-24-17-18-27-51(46)79-12)34-40-28-30-42(31-29-40)56(74)65-45-33-49(57(75)66-48-26-19-23-41-20-15-16-25-47(41)48)71(36-45)60(78)53(62(7,8)9)68-55(73)38(2)64-11/h13-18,20-22,24-25,27-31,37-39,45,48-50,52-53,63-64H,19,23,26,32-36H2,1-12H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t37-,38-,39?,45?,48?,49-,50-,52+,53+/m0/s1 NNUBYITXSVFHFX-VWJDLKNGSA-N 312113 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-((R)-1-(2- methoxyphenyl) ethyl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 24 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 60.0 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312113&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106629 383539099 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600061 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)Cc2ccccc2F)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C62H82FN9O7/c1-37(31-44-21-15-17-25-48(44)63)70(58(77)51-32-43-20-12-13-22-45(43)35-71(51)59(78)52(61(4,5)6)68-54(73)38(2)64-10)34-40-27-29-42(30-28-40)56(75)66-46-33-50(57(76)67-49-26-18-23-41-19-14-16-24-47(41)49)72(36-46)60(79)53(62(7,8)9)69-55(74)39(3)65-11/h12-17,19-22,24-25,27-30,37-39,46,49-53,64-65H,18,23,26,31-36H2,1-11H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t37?,38-,39-,46?,49?,50-,51-,52+,53+/m0/s1 AZOAWRFEIPJHAZ-JAXRXAILSA-N 312114 (S)-2-((S)-3,3- Dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin- 3-yl)carbamoyl) benzyl)-N-((R)- 1-(2-fluorophenyl) propan-2-yl)- 1,2,3,4-tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 25 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 650 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312114&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106630 383539100 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600063 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)c2ccccc2Cl)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C61H80ClN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)70-34-43-21-13-12-20-42(43)31-50(70)57(76)69(38(3)45-23-16-17-25-47(45)62)33-39-27-29-41(30-28-39)55(74)65-44-32-49(56(75)66-48-26-18-22-40-19-14-15-24-46(40)48)71(35-44)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-17,19-21,23-25,27-30,36-38,44,48-52,63-64H,18,22,26,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38?,44?,48?,49-,50-,51+,52+/m0/s1 JUQLTUQEOXZVES-VZJDYDFESA-N 312115 (3S)-N-(1-(2- Chlorophenyl) ethyl)-2-((S)-3,3- dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- 1,2,3,4-tetra- hydroisoquinoline- 3-carboxamide::US9603889, Example 26 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 100.0 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312115&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106631 383539101 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600065 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN([C@H](C)Cc2ccccc2F)C(=O)[C@H]2N(CCc3ccccc23)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C62H82FN9O7/c1-37(33-44-21-14-17-25-48(44)63)71(58(77)51-47-24-16-13-20-42(47)31-32-70(51)59(78)52(61(4,5)6)68-54(73)38(2)64-10)35-40-27-29-43(30-28-40)56(75)66-45-34-50(57(76)67-49-26-18-22-41-19-12-15-23-46(41)49)72(36-45)60(79)53(62(7,8)9)69-55(74)39(3)65-11/h12-17,19-21,23-25,27-30,37-39,45,49-53,64-65H,18,22,26,31-36H2,1-11H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t37-,38+,39+,45?,49?,50+,51+,52-,53-/m1/s1 ZUAAEZJCFHSIOK-WCHMCIFBSA-N 312116 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)- N-(4-(((3S,5S)-1- ((S)-3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl) carbamoyl) benzyl)-N-((R)-1- (2-fluorophenyl) propan-2-yl)- 1,2,3,4-tetrahydro- isoquinoline- 1-carboxamide::US9603889, Example 27 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1740 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312116&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106632 383539102 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600067 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)c2ccccc2C)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C62H83N9O7/c1-37-20-13-17-25-47(37)40(4)69(58(76)51-32-44-22-14-15-23-45(44)35-70(51)59(77)52(61(5,6)7)67-54(72)38(2)63-11)34-41-28-30-43(31-29-41)56(74)65-46-33-50(57(75)66-49-27-19-24-42-21-16-18-26-48(42)49)71(36-46)60(78)53(62(8,9)10)68-55(73)39(3)64-12/h13-18,20-23,25-26,28-31,38-40,46,49-53,63-64H,19,24,27,32-36H2,1-12H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t38-,39-,40?,46?,49?,50-,51-,52+,53+/m0/s1 LMFQEYJRLPLECC-SAHLMDJCSA-N 312117 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)- N-(4-(((3S,5S)-1- ((S)-3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen-1- yl)carbamoyl) pyrrolidin-3-yl) carbamoyl)benzyl)- N-((R)-1-(o-tolyl) ethyl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 28 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 250 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312117&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106633 383539103 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600069 CCOc1ccccc1[C@@H](C)N(Cc1ccc(cc1)C(=O)NC1C[C@H](N(C1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C InChI=1S/C63H85N9O8/c1-13-80-52-28-19-18-25-47(52)40(4)70(59(77)51-33-44-22-14-15-23-45(44)36-71(51)60(78)53(62(5,6)7)68-55(73)38(2)64-11)35-41-29-31-43(32-30-41)57(75)66-46-34-50(58(76)67-49-27-20-24-42-21-16-17-26-48(42)49)72(37-46)61(79)54(63(8,9)10)69-56(74)39(3)65-12/h14-19,21-23,25-26,28-32,38-40,46,49-51,53-54,64-65H,13,20,24,27,33-37H2,1-12H3,(H,66,75)(H,67,76)(H,68,73)(H,69,74)/t38-,39-,40+,46?,49?,50-,51-,53+,54+/m0/s1 BZYLXAPGOBAABU-WUBRCICJSA-N 312118 (S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-N-(4- (((3S,5S)-1-((S)- 3,3-dimethyl-2- ((S)-2-(methyl- amino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetra- hydronaphthalen-1- yl)carbamoyl) pyrrolidin- 3-yl)carbamoyl) benzyl)-N-((R)- 1-(2-ethoxyphenyl) ethyl)-1,2,3,4- tetrahydro- isoquinoline- 3-carboxamide::US9603889, Example 29 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 340 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312118 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312118&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106634 383539104 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600071 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@H](C)Cc1ccc2ccccc2c1)C(C)(C)C InChI=1S/C66H85N9O7/c1-40(33-43-27-28-44-19-12-13-21-48(44)34-43)73(39-52-35-49-22-14-15-23-50(49)37-74(52)63(81)56(65(4,5)6)71-58(76)41(2)67-10)62(80)47-31-29-46(30-32-47)60(78)69-51-36-55(61(79)70-54-26-18-24-45-20-16-17-25-53(45)54)75(38-51)64(82)57(66(7,8)9)72-59(77)42(3)68-11/h12-17,19-23,25,27-32,34,40-42,51-52,54-57,67-68H,18,24,26,33,35-39H2,1-11H3,(H,69,78)(H,70,79)(H,71,76)(H,72,77)/t40-,41+,42+,51+,52+,54-,55+,56-,57-/m1/s1 PVPQDLGMPIVRTP-KMKAQRCYSA-N 312119 N1-(((S)-2-((S)-3,3- Dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin-3- yl)methyl)-N4- ((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)-N1- ((R)-1-(naphthalen- 2-yl)propan-2-yl) terephthalamide::US9603889, Example 30 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 760 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312119&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330717 383539105 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600073 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@H](C)c1ccc2ccccc2c1)C(C)(C)C InChI=1S/C65H83N9O7/c1-39(66-10)57(75)70-55(64(4,5)6)62(80)73-36-49-23-15-14-22-48(49)34-51(73)38-72(41(3)46-32-27-42-19-12-13-21-47(42)33-46)61(79)45-30-28-44(29-31-45)59(77)68-50-35-54(60(78)69-53-26-18-24-43-20-16-17-25-52(43)53)74(37-50)63(81)56(65(7,8)9)71-58(76)40(2)67-11/h12-17,19-23,25,27-33,39-41,50-51,53-56,66-67H,18,24,26,34-38H2,1-11H3,(H,68,77)(H,69,78)(H,70,75)(H,71,76)/t39-,40-,41+,50-,51-,53+,54-,55+,56+/m0/s1 QTSIMALYUDCMPK-KQRVCALPSA-N 312120 N1-(((S)-2-((S)-3,3- Dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin-3-yl) methyl)-N4- ((3S,5S)-1- ((S)-3,3-dimethyl- 2-((S)-2-(methyl- amino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)-N1- ((R)-1-(naphthalen- 2-yl)ethyl) terephthalamide::US9603889, Example 31 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1690 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312120&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330676 383539106 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600075 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(CCc1ccc2ccccc2c1)C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(C)(C)C InChI=1S/C65H83N9O7/c1-40(66-9)57(75)70-55(64(3,4)5)62(80)73-37-49-22-14-13-21-48(49)35-51(73)39-72(33-32-42-26-27-43-18-11-12-20-47(43)34-42)61(79)46-30-28-45(29-31-46)59(77)68-50-36-54(60(78)69-53-25-17-23-44-19-15-16-24-52(44)53)74(38-50)63(81)56(65(6,7)8)71-58(76)41(2)67-10/h11-16,18-22,24,26-31,34,40-41,50-51,53-56,66-67H,17,23,25,32-33,35-39H2,1-10H3,(H,68,77)(H,69,78)(H,70,75)(H,71,76)/t40-,41-,50-,51-,53+,54-,55+,56+/m0/s1 HJRHYWAIFLGMJQ-SWODDILSSA-N 312121 N1-(((S)-2-((S)- 3,3-Dimethyl-2- ((S)-2-(methyl- amino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin-3-yl) methyl)-N4- ((3S,5S)-1-((S)-3,3- dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)- N1-(2-(naphthalen- 2-yl)ethyl) terephthalamide::US9603889, Example 32 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 800 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312121&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330718 383539107 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600077 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(CCc1cccc2ccccc12)C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(C)(C)C InChI=1S/C65H83N9O7/c1-40(66-9)57(75)70-55(64(3,4)5)62(80)73-37-48-22-12-11-21-47(48)35-50(73)39-72(34-33-44-24-17-23-42-19-13-15-26-51(42)44)61(79)46-31-29-45(30-32-46)59(77)68-49-36-54(60(78)69-53-28-18-25-43-20-14-16-27-52(43)53)74(38-49)63(81)56(65(6,7)8)71-58(76)41(2)67-10/h11-17,19-24,26-27,29-32,40-41,49-50,53-56,66-67H,18,25,28,33-39H2,1-10H3,(H,68,77)(H,69,78)(H,70,75)(H,71,76)/t40-,41-,49-,50-,53+,54-,55+,56+/m0/s1 UXJVAMCICAERKY-XSURLAPZSA-N 312122 N1-(((S)-2-((S)- 3,3-Dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin- 3-yl)methyl)- N4-((3S,5S)- 1-((S)-3,3- dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)-N1- (2-(naphthalen-1- yl)ethyl) terephthalamide::US9603889, Example 33 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 900 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312122&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330689 383539108 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600079 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)Cc1cccc2ccccc12)C(C)(C)C InChI=1S/C64H81N9O7/c1-39(65-9)56(74)69-54(63(3,4)5)61(79)72-36-46-22-12-11-21-45(46)33-49(72)38-71(35-47-25-17-23-41-19-13-15-26-50(41)47)60(78)44-31-29-43(30-32-44)58(76)67-48-34-53(59(77)68-52-28-18-24-42-20-14-16-27-51(42)52)73(37-48)62(80)55(64(6,7)8)70-57(75)40(2)66-10/h11-17,19-23,25-27,29-32,39-40,48-49,52-55,65-66H,18,24,28,33-38H2,1-10H3,(H,67,76)(H,68,77)(H,69,74)(H,70,75)/t39-,40-,48-,49-,52+,53-,54+,55+/m0/s1 CWUBQRWNMSQJRE-YDSNTJDVSA-N 312123 N1-(((S)-2-((S)- 3,3-Dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin-3-yl) methyl)-N4- ((3S,5S)-1-((S)-3,3- dimethyl-2- ((S)-2- (methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)- N1-(naphthalen-1- ylmethyl) terephthalamide::US9603889, Example 34 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1570 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312123&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330855 383539109 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600081 CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2ccccc2C[C@H]1CN(Cc1cccc(C)c1C)C(=O)c1ccc(cc1)C(=O)Cc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C68H86N8O7/c1-41-19-17-24-51(42(41)2)37-74(40-54-35-49-21-13-14-22-52(49)38-75(54)65(82)59(67(5,6)7)72-61(78)43(3)69-11)64(81)48-31-29-47(30-32-48)58(77)34-45-27-28-50-36-57(63(80)71-56-26-18-23-46-20-15-16-25-55(46)56)76(39-53(50)33-45)66(83)60(68(8,9)10)73-62(79)44(4)70-12/h13-17,19-22,24-25,27-33,43-44,54,56-57,59-60,69-70H,18,23,26,34-40H2,1-12H3,(H,71,80)(H,72,78)(H,73,79)/t43-,44-,54-,56+,57-,59+,60+/m0/s1 DPTZSNVXBNIDSZ-RBKKZXDISA-N 312124 N1-(((S)-2-((S)- 3,3-Dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 1,2,3,4-tetra- hydroisoquinolin- 3-yl)methyl)- N4-((S)-2-((S)- 3,3-dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)- 3-(((R)-1,2,3,4- tetrahydro- naphthalen-1- yl)carbamoyl)- 1,2,3,4-tetra- hydroisoquinolin- 7-yl)-N1-(2,3- dimethylbenzyl) terephthalamide::US9603889, Example 35 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1810 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312124&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330669 383539110 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600083 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)Cc1cccc(C)c1C)C(C)(C)C InChI=1S/C62H83N9O7/c1-37-19-17-24-45(38(37)2)33-69(36-48-31-44-21-13-14-22-46(44)34-70(48)59(77)52(61(5,6)7)67-54(72)39(3)63-11)58(76)43-29-27-42(28-30-43)56(74)65-47-32-51(57(75)66-50-26-18-23-41-20-15-16-25-49(41)50)71(35-47)60(78)53(62(8,9)10)68-55(73)40(4)64-12/h13-17,19-22,24-25,27-30,39-40,47-48,50-53,63-64H,18,23,26,31-36H2,1-12H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t39-,40-,47-,48-,50+,51-,52+,53+/m0/s1 AECFEAWCZCFJCP-LSYVJHDCSA-N 312125 N1-(((S)-2-((S)- 3,3-Dimethyl- 2-((S)-2- (methylamino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin-3-yl) methyl)-N4- ((3S,5S)-1-((S)-3,3- dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)- 5-(((R)-1,2,3,4- tetrahydro- naphthalen- 1-yl)carbamoyl) pyrrolidin-3-yl)-N1- (2,3-dimethyl- benzyl) terephthalamide::US9603889, Example 36 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1290 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312125&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330705 383539111 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600085 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)N(C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@H](C)c1ccccc1F)C(C)(C)C InChI=1S/C61H80FN9O7/c1-36(63-10)53(72)67-51(60(4,5)6)58(77)70-33-43-21-13-12-20-42(43)31-45(70)35-69(38(3)46-23-16-17-25-48(46)62)57(76)41-29-27-40(28-30-41)55(74)65-44-32-50(56(75)66-49-26-18-22-39-19-14-15-24-47(39)49)71(34-44)59(78)52(61(7,8)9)68-54(73)37(2)64-11/h12-17,19-21,23-25,27-30,36-38,44-45,49-52,63-64H,18,22,26,31-35H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t36-,37-,38+,44-,45-,49+,50-,51+,52+/m0/s1 SVZWWJONRRRSQO-LHSYOQMASA-N 312126 N1-(((S)-2- ((S)-3,3- Dimethyl-2-((S)- 2-(methylamino) propanamido) butanoyl)-1,2,3,4- tetrahydro- isoquinolin-3-yl) methyl)-N4- ((3S,5S)- 1-((S)-3,3- dimethyl-2-((S)-2- (methylamino) propanamido) butanoyl)-5-(((R)- 1,2,3,4-tetrahydro- naphthalen-1-yl) carbamoyl) pyrrolidin- 3-yl)-N1-((R)-1-(2- fluorophenyl) ethyl) terephthalamide::US9603889, Example 37 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 650 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312126&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118330708 383539112 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600087 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)C1(CN([C@@H](COC)c2ccccc2)C(=O)C2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)CC1)C(C)(C)C InChI=1S/C59H83N9O8/c1-36(60-9)50(69)64-48(57(3,4)5)54(73)66-32-41-24-16-15-23-40(41)30-46(66)53(72)68(47(34-76-11)39-21-13-12-14-22-39)35-59(28-29-59)56(75)62-42-31-45(52(71)63-44-27-19-25-38-20-17-18-26-43(38)44)67(33-42)55(74)49(58(6,7)8)65-51(70)37(2)61-10/h12-18,20-24,26,36-37,42,44-49,60-61H,19,25,27-35H2,1-11H3,(H,62,75)(H,63,71)(H,64,69)(H,65,70)/t36-,37-,42?,44?,45-,46?,47-,48+,49+/m0/s1 PIHSUMCMZMLTFD-SJEOLFCRSA-N 312127 US9603889, Example 38 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 220 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312127&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106635 383539113 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600089 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1cccc(CN([C@@H](COC)c2ccccc2)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)c1)C(C)(C)C InChI=1S/C62H83N9O8/c1-38(63-9)54(72)67-52(61(3,4)5)59(77)70-35-45-26-16-15-25-43(45)32-50(70)58(76)69(51(37-79-11)42-23-13-12-14-24-42)34-40-21-19-28-44(31-40)56(74)65-46-33-49(57(75)66-48-30-20-27-41-22-17-18-29-47(41)48)71(36-46)60(78)53(62(6,7)8)68-55(73)39(2)64-10/h12-19,21-26,28-29,31,38-39,46,48-53,63-64H,20,27,30,32-37H2,1-11H3,(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t38-,39-,46?,48?,49-,50-,51-,52+,53+/m0/s1 CVLUVKNSLZDXBF-HSBWPWBRSA-N 312128 US9603889, Example 39 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 320 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312128&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106636 383539114 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600091 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)CN([C@@H](COC)c1ccccc1)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(C)(C)C InChI=1S/C56H79N9O8/c1-34(57-9)49(67)61-47(55(3,4)5)53(71)63-30-39-24-16-15-23-38(39)28-44(63)52(70)65(45(33-73-11)37-21-13-12-14-22-37)32-46(66)59-40-29-43(51(69)60-42-27-19-25-36-20-17-18-26-41(36)42)64(31-40)54(72)48(56(6,7)8)62-50(68)35(2)58-10/h12-18,20-24,26,34-35,40,42-45,47-48,57-58H,19,25,27-33H2,1-11H3,(H,59,66)(H,60,69)(H,61,67)(H,62,68)/t34-,35-,40?,42?,43-,44-,45-,47+,48+/m0/s1 ANVSTNUPBVSCPB-NUGPNQOBSA-N 312129 US9603889, Example 40 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1210 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312129&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106637 383539115 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600093 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)CCCN([C@H](C)c1ccccc1F)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(C)(C)C InChI=1S/C57H80FN9O7/c1-34(59-10)50(69)63-48(56(4,5)6)54(73)66-32-39-22-13-12-21-38(39)30-46(66)53(72)65(36(3)41-24-16-17-26-43(41)58)29-19-28-47(68)61-40-31-45(52(71)62-44-27-18-23-37-20-14-15-25-42(37)44)67(33-40)55(74)49(57(7,8)9)64-51(70)35(2)60-11/h12-17,20-22,24-26,34-36,40,44-46,48-49,59-60H,18-19,23,27-33H2,1-11H3,(H,61,68)(H,62,71)(H,63,69)(H,64,70)/t34-,35-,36+,40?,44?,45-,46-,48+,49+/m0/s1 WXMJSBVKFBYMQY-GTMMZRPLSA-N 312130 US9603889, Example 41 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 110 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312130&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106638 383539116 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600095 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)C1CC1CN([C@H](C)c1ccccc1F)C(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(C)(C)C InChI=1S/C58H80FN9O7/c1-33(60-10)50(69)64-48(57(4,5)6)55(74)67-30-38-21-13-12-20-37(38)28-47(67)54(73)66(35(3)41-23-16-17-25-44(41)59)31-39-27-43(39)52(71)62-40-29-46(53(72)63-45-26-18-22-36-19-14-15-24-42(36)45)68(32-40)56(75)49(58(7,8)9)65-51(70)34(2)61-11/h12-17,19-21,23-25,33-35,39-40,43,45-49,60-61H,18,22,26-32H2,1-11H3,(H,62,71)(H,63,72)(H,64,69)(H,65,70)/t33-,34-,35+,39?,40?,43?,45?,46-,47-,48+,49+/m0/s1 GBSDPUWDHRVCLO-UZWRGSAHSA-N 312131 US9603889, Example 42 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 330 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312131&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106639 383539117 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 600097 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)C1(CN([C@H](C)c2cccc(F)c2F)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)CC1)C(C)(C)C InChI=1S/C58H79F2N9O7/c1-33(61-10)49(70)65-47(56(4,5)6)53(74)67-30-38-20-13-12-19-37(38)28-45(67)52(73)69(35(3)40-23-17-24-42(59)46(40)60)32-58(26-27-58)55(76)63-39-29-44(51(72)64-43-25-16-21-36-18-14-15-22-41(36)43)68(31-39)54(75)48(57(7,8)9)66-50(71)34(2)62-11/h12-15,17-20,22-24,33-35,39,43-45,47-48,61-62H,16,21,25-32H2,1-11H3,(H,63,76)(H,64,72)(H,65,70)(H,66,71)/t33-,34-,35+,39?,43?,44-,45-,47+,48+/m0/s1 GJURNFNFVYYRMJ-WQFGBWTFSA-N 312132 US9603889, Example 43 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 150 US Patent 10.7270/Q2C53NXV aid1796361 US9603889 Kim, KS; Zhang, L; Wei, DD Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312132&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106640 383539118 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603722 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(O)=O)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C80H96N16O14/c1-45(81-9)69(97)87-67(79(3,4)5)75(103)93-33-31-63-65(93)73(101)83-59(39-49-19-25-51-15-11-13-17-53(51)35-49)71(99)85-61(77(105)106)37-47-23-29-58(30-24-47)110-44-56-42-96(92-90-56)64-32-34-94(76(104)68(80(6,7)8)88-70(98)46(2)82-10)66(64)74(102)84-60(40-50-20-26-52-16-12-14-18-54(52)36-50)72(100)86-62(78(107)108)38-48-21-27-57(28-22-48)109-43-55-41-95(63)91-89-55/h11-30,35-36,41-42,45-46,59-68,81-82H,31-34,37-40,43-44H2,1-10H3,(H,83,101)(H,84,102)(H,85,99)(H,86,100)(H,87,97)(H,88,98)(H,105,106)(H,107,108)/t45-,46-,59-,60-,61-,62-,63+,64+,65-,66-,67+,68+/m0/s1 MBKNBOLIPVRUSC-YZMHPAFASA-N 312966 US9605022, Example 1 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1.10 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312966&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 90155550 383539915 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603724 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@H]2OCc3cn(CC[C@@H](NC(=O)[C@H](Cc4ccc5ccccc5c4)NC(=O)[C@@H]4[C@@H](CCN4C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)OCc4cn(CC[C@@H](NC(=O)[C@H](Cc5ccc6ccccc6c5)NC(=O)[C@@H]12)C(O)=O)nn4)C(O)=O)nn3)C(C)(C)C InChI=1S/C70H92N16O14/c1-39(71-9)59(87)77-57(69(3,4)5)65(93)85-29-25-53-55(85)63(91)75-51(33-41-19-21-43-15-11-13-17-45(43)31-41)61(89)73-49(67(95)96)23-28-84-36-48(80-82-84)38-100-54-26-30-86(66(94)58(70(6,7)8)78-60(88)40(2)72-10)56(54)64(92)76-52(34-42-20-22-44-16-12-14-18-46(44)32-42)62(90)74-50(68(97)98)24-27-83-35-47(37-99-53)79-81-83/h11-22,31-32,35-36,39-40,49-58,71-72H,23-30,33-34,37-38H2,1-10H3,(H,73,89)(H,74,90)(H,75,91)(H,76,92)(H,77,87)(H,78,88)(H,95,96)(H,97,98)/t39-,40-,49+,50+,51-,52-,53+,54+,55-,56-,57+,58+/m0/s1 FZGZIFOUNRXAQH-SXFVIKMQSA-N 312967 US9605022, Example 2 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 5.20 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312967&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118428895 383539916 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603726 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@H]2OCc3cn(CCC[C@@H](NC(=O)[C@H](Cc4ccc5ccccc5c4)NC(=O)[C@@H]4[C@@H](CCN4C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)OCc4cn(CCC[C@@H](NC(=O)[C@H](Cc5ccc6ccccc6c5)NC(=O)[C@@H]12)C(O)=O)nn4)C(O)=O)nn3)C(C)(C)C InChI=1S/C72H96N16O14/c1-41(73-9)61(89)79-59(71(3,4)5)67(95)87-31-27-55-57(87)65(93)77-53(35-43-23-25-45-17-11-13-19-47(45)33-43)63(91)75-51(69(97)98)21-15-30-86-38-50(82-84-86)40-102-56-28-32-88(68(96)60(72(6,7)8)80-62(90)42(2)74-10)58(56)66(94)78-54(36-44-24-26-46-18-12-14-20-48(46)34-44)64(92)76-52(70(99)100)22-16-29-85-37-49(39-101-55)81-83-85/h11-14,17-20,23-26,33-34,37-38,41-42,51-60,73-74H,15-16,21-22,27-32,35-36,39-40H2,1-10H3,(H,75,91)(H,76,92)(H,77,93)(H,78,94)(H,79,89)(H,80,90)(H,97,98)(H,99,100)/t41-,42-,51+,52+,53-,54-,55+,56+,57-,58-,59+,60+/m0/s1 UZIAKDBFVNIMHM-AHKGGJCZSA-N 312968 US9605022, Example 3 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 0.800 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312968&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118429216 383539917 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603728 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@H]2OCc3cn(nn3)[C@@H](CCNC(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@@H]3[C@@H](CCN3C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)OCc3cn(nn3)[C@@H](CCNC(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@@H]12)C(O)=O)C(O)=O)C(C)(C)C InChI=1S/C70H92N16O14/c1-39(71-9)59(87)77-57(69(3,4)5)65(93)83-29-25-53-55(83)63(91)75-49(33-41-19-21-43-15-11-13-17-45(43)31-41)61(89)73-27-23-52(68(97)98)86-36-48(80-82-86)38-100-54-26-30-84(66(94)58(70(6,7)8)78-60(88)40(2)72-10)56(54)64(92)76-50(34-42-20-22-44-16-12-14-18-46(44)32-42)62(90)74-28-24-51(67(95)96)85-35-47(37-99-53)79-81-85/h11-22,31-32,35-36,39-40,49-58,71-72H,23-30,33-34,37-38H2,1-10H3,(H,73,89)(H,74,90)(H,75,91)(H,76,92)(H,77,87)(H,78,88)(H,95,96)(H,97,98)/t39-,40-,49-,50-,51-,52-,53+,54+,55-,56-,57+,58+/m0/s1 SLDGGQPUIMOVMN-LUYVCQRVSA-N 312969 US9605022, Example 4 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1.60 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312969&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118429237 383539918 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603730 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@H]2OCc3cn(nn3)[C@@H](CCCNC(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@@H]3[C@@H](CCN3C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)OCc3cn(nn3)[C@@H](CCCNC(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@@H]12)C(=O)NS(C)(=O)=O)C(=O)NS(C)(=O)=O)C(C)(C)C InChI=1S/C74H102N18O16S2/c1-43(75-9)63(93)81-61(73(3,4)5)71(101)89-33-29-57-59(89)69(99)79-53(37-45-25-27-47-19-13-15-21-49(47)35-45)65(95)77-31-17-23-56(68(98)86-110(12,105)106)92-40-52(84-88-92)42-108-58-30-34-90(72(102)62(74(6,7)8)82-64(94)44(2)76-10)60(58)70(100)80-54(38-46-26-28-48-20-14-16-22-50(48)36-46)66(96)78-32-18-24-55(67(97)85-109(11,103)104)91-39-51(41-107-57)83-87-91/h13-16,19-22,25-28,35-36,39-40,43-44,53-62,75-76H,17-18,23-24,29-34,37-38,41-42H2,1-12H3,(H,77,95)(H,78,96)(H,79,99)(H,80,100)(H,81,93)(H,82,94)(H,85,97)(H,86,98)/t43-,44-,53-,54-,55-,56-,57+,58+,59-,60-,61+,62+/m0/s1 FJGQHCYSBKZATB-ZSHHDKMESA-N 312970 US9605022, Example 5 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 8.00 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312970&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118429221 383539919 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603732 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)OC)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(=O)NS(=O)(=O)C1CC1)C(C)(C)C InChI=1S/C84H103N17O15S/c1-48(85-9)73(102)91-71(83(3,4)5)80(109)98-36-34-67-69(98)78(107)88-63(42-52-20-26-54-16-12-14-18-56(54)38-52)75(104)87-65(77(106)95-117(112,113)62-32-33-62)40-50-22-28-60(29-23-50)115-46-58-44-101(97-93-58)68-35-37-99(81(110)72(84(6,7)8)92-74(103)49(2)86-10)70(68)79(108)89-64(43-53-21-27-55-17-13-15-19-57(55)39-53)76(105)90-66(82(111)114-11)41-51-24-30-61(31-25-51)116-47-59-45-100(67)96-94-59/h12-31,38-39,44-45,48-49,62-72,85-86H,32-37,40-43,46-47H2,1-11H3,(H,87,104)(H,88,107)(H,89,108)(H,90,105)(H,91,102)(H,92,103)(H,95,106)/t48-,49-,63-,64-,65-,66-,67+,68+,69-,70-,71+,72+/m0/s1 GUYDSOLIABCZFM-OEKHCWRBSA-N 312971 US9605022, Example 6 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2.40 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312971&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118429189 383539920 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603734 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)C[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)OC)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C81H98N14O13/c1-47(82-9)72(97)86-70(80(3,4)5)76(101)92-34-32-65-68(92)62(39-52-21-27-54-17-13-15-19-56(54)37-52)75(100)84-63(78(103)104)40-49-22-28-60(29-23-49)108-46-59-44-95(91-89-59)66-33-35-93(77(102)71(81(6,7)8)87-73(98)48(2)83-10)69(66)67(96)42-57(38-51-20-26-53-16-12-14-18-55(53)36-51)74(99)85-64(79(105)106-11)41-50-24-30-61(31-25-50)107-45-58-43-94(65)90-88-58/h12-31,36-37,43-44,47-48,57,62-66,68-71,82-83H,32-35,38-42,45-46H2,1-11H3,(H,84,100)(H,85,99)(H,86,97)(H,87,98)(H,103,104)/t47-,48-,57+,62+,63-,64-,65+,66+,68+,69-,70+,71+/m0/s1 QTFUECSQPZFYEM-JQPLRMHWSA-N 312972 US9605022, Example 7 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 6.50 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312972&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106677 383539921 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603736 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)NC(=O)C[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)NCc2cc(F)c(O)c(F)c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C89H103F2N17O15/c1-49(92-9)78(111)99-76(88(3,4)5)85(118)105-33-31-70-73(105)83(116)96-68(42-54-20-26-57-16-12-14-18-59(57)36-54)82(115)97-69(87(120)121)41-52-23-29-64(30-24-52)123-48-62-46-108(104-102-62)71-32-34-106(86(119)77(89(6,7)8)100-79(112)50(2)93-10)74(71)84(117)98-72(109)43-60(37-53-19-25-56-15-11-13-17-58(56)35-53)80(113)95-67(81(114)94-44-55-38-65(90)75(110)66(91)39-55)40-51-21-27-63(28-22-51)122-47-61-45-107(70)103-101-61/h11-30,35-36,38-39,45-46,49-50,60,67-71,73-74,76-77,92-93,110H,31-34,37,40-44,47-48H2,1-10H3,(H,94,114)(H,95,113)(H,96,116)(H,97,115)(H,99,111)(H,100,112)(H,120,121)(H,98,109,117)/t49-,50-,60+,67-,68-,69-,70+,71+,73-,74-,76+,77+/m0/s1 NOVQMSAXBZDRHD-GRFCGMDYSA-N 312973 US9605022, Example 8 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1.20 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312973&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106678 383539922 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603738 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)NC(=O)C[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)NCc2cc(F)c(O)c(F)c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(=O)OC)C(C)(C)C InChI=1S/C90H105F2N17O15/c1-50(93-9)79(112)100-77(89(3,4)5)86(119)106-34-32-71-74(106)84(117)97-69(43-55-21-27-58-17-13-15-19-60(58)37-55)83(116)98-70(88(121)122-11)42-53-24-30-65(31-25-53)124-49-63-47-109(105-103-63)72-33-35-107(87(120)78(90(6,7)8)101-80(113)51(2)94-10)75(72)85(118)99-73(110)44-61(38-54-20-26-57-16-12-14-18-59(57)36-54)81(114)96-68(82(115)95-45-56-39-66(91)76(111)67(92)40-56)41-52-22-28-64(29-23-52)123-48-62-46-108(71)104-102-62/h12-31,36-37,39-40,46-47,50-51,61,68-72,74-75,77-78,93-94,111H,32-35,38,41-45,48-49H2,1-11H3,(H,95,115)(H,96,114)(H,97,117)(H,98,116)(H,100,112)(H,101,113)(H,99,110,118)/t50-,51-,61+,68-,69-,70-,71+,72+,74-,75-,77+,78+/m0/s1 BAODQHPEQZHMBP-ZLUOGFKFSA-N 312975 US9605022, Example 9 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2.70 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312975&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106679 383539924 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603740 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)NS(=O)(=O)c2ccccn2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C85H100N18O15S/c1-49(86-9)74(104)93-72(84(3,4)5)81(111)100-37-34-67-70(100)79(109)90-63(43-53-22-28-55-17-11-13-19-57(55)39-53)76(106)89-65(78(108)97-119(115,116)69-21-15-16-36-88-69)41-51-24-30-61(31-25-51)117-47-59-45-103(99-95-59)68-35-38-101(82(112)73(85(6,7)8)94-75(105)50(2)87-10)71(68)80(110)91-64(44-54-23-29-56-18-12-14-20-58(56)40-54)77(107)92-66(83(113)114)42-52-26-32-62(33-27-52)118-48-60-46-102(67)98-96-60/h11-33,36,39-40,45-46,49-50,63-68,70-73,86-87H,34-35,37-38,41-44,47-48H2,1-10H3,(H,89,106)(H,90,109)(H,91,110)(H,92,107)(H,93,104)(H,94,105)(H,97,108)(H,113,114)/t49-,50-,63-,64-,65-,66-,67+,68+,70-,71-,72+,73+/m0/s1 RHIZHSHCAUUNTD-MOPRESEOSA-N 312976 US9605022, Example 10 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 16.9 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312976&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118428898 383539925 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603742 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)NS(=O)(=O)C2CC2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C83H101N17O15S/c1-47(84-9)72(101)90-70(82(3,4)5)79(108)97-35-33-66-68(97)77(106)87-62(41-51-19-25-53-15-11-13-17-55(53)37-51)74(103)86-64(76(105)94-116(112,113)61-31-32-61)39-49-21-27-59(28-22-49)114-45-57-43-100(96-92-57)67-34-36-98(80(109)71(83(6,7)8)91-73(102)48(2)85-10)69(67)78(107)88-63(42-52-20-26-54-16-12-14-18-56(54)38-52)75(104)89-65(81(110)111)40-50-23-29-60(30-24-50)115-46-58-44-99(66)95-93-58/h11-30,37-38,43-44,47-48,61-71,84-85H,31-36,39-42,45-46H2,1-10H3,(H,86,103)(H,87,106)(H,88,107)(H,89,104)(H,90,101)(H,91,102)(H,94,105)(H,110,111)/t47-,48-,62-,63-,64-,65-,66+,67+,68-,69-,70+,71+/m0/s1 QTPJJORUJRBSTP-VVJSROEGSA-N 312977 US9605022, Example 11 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1.30 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312977&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118429191 383539926 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603744 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)NS(=O)(=O)C2CC2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C83H101N17O15S/c1-47(84-9)72(101)90-70(82(3,4)5)79(108)97-35-33-66-68(97)77(106)87-62(41-51-19-25-53-15-11-13-17-55(53)37-51)74(103)86-64(76(105)94-116(112,113)61-31-32-61)39-49-21-27-59(28-22-49)114-45-57-43-100(96-92-57)67-34-36-98(80(109)71(83(6,7)8)91-73(102)48(2)85-10)69(67)78(107)88-63(42-52-20-26-54-16-12-14-18-56(54)38-52)75(104)89-65(81(110)111)40-50-23-29-60(30-24-50)115-46-58-44-99(66)95-93-58/h11-30,37-38,43-44,47-48,61-71,84-85H,31-36,39-42,45-46H2,1-10H3,(H,86,103)(H,87,106)(H,88,107)(H,89,104)(H,90,101)(H,91,102)(H,94,105)(H,110,111)/t47-,48-,62+,63-,64-,65-,66+,67+,68-,69-,70+,71+/m0/s1 QTPJJORUJRBSTP-XCZJTPFPSA-N 312978 US9605022, Example 12 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 5.70 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312978&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118428897 383539927 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603746 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)NC(=O)C[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(=O)NCC[C@@H](O)C[C@@H](O)CC(O)=O)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C InChI=1S/C89H111N17O18/c1-50(90-9)78(112)97-76(88(3,4)5)85(119)103-35-32-70-74(103)83(117)94-68(42-55-20-26-57-16-12-14-18-59(57)38-55)82(116)95-69(87(121)122)41-53-23-29-66(30-24-53)124-49-62-47-106(102-100-62)71-33-36-104(86(120)77(89(6,7)8)98-79(113)51(2)91-10)75(71)84(118)96-72(109)43-60(39-54-19-25-56-15-11-13-17-58(56)37-54)80(114)93-67(81(115)92-34-31-63(107)44-64(108)45-73(110)111)40-52-21-27-65(28-22-52)123-48-61-46-105(70)101-99-61/h11-30,37-38,46-47,50-51,60,63-64,67-71,74-77,90-91,107-108H,31-36,39-45,48-49H2,1-10H3,(H,92,115)(H,93,114)(H,94,117)(H,95,116)(H,97,112)(H,98,113)(H,110,111)(H,121,122)(H,96,109,118)/t50-,51-,60+,63+,64+,67-,68-,69-,70+,71+,74-,75-,76+,77+/m0/s1 BOHYEMVPKFXRSG-OPNQBICOSA-N 312979 US9605022, Example 13 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1.40 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312979&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118428899 383539928 C03834 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603748 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)NC(=O)C[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)C(O)=O)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)c1n[nH]c(=O)o1)C(C)(C)C 312981 US9605022, Example 14 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1.30 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312981 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312981&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106680 383539930 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603750 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@H](C(=O)OC)c3ccc(OCc4cn2nn4)cc3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C#N)C(C)(C)C InChI=1S/C80H95N17O12/c1-46(82-9)70(98)88-68(79(3,4)5)76(104)94-34-32-63-66(94)74(102)85-61(39-49-20-24-51-16-12-14-18-54(51)36-49)72(100)84-56(41-81)38-48-22-28-59(29-23-48)108-44-57-42-96(92-90-57)64-33-35-95(77(105)69(80(6,7)8)89-71(99)47(2)83-10)67(64)75(103)86-62(40-50-21-25-52-17-13-15-19-55(52)37-50)73(101)87-65(78(106)107-11)53-26-30-60(31-27-53)109-45-58-43-97(63)93-91-58/h12-31,36-37,42-43,46-47,56,61-69,82-83H,32-35,38-40,44-45H2,1-11H3,(H,84,100)(H,85,102)(H,86,103)(H,87,101)(H,88,98)(H,89,99)/t46-,47-,56-,61-,62-,63+,64+,65-,66?,67-,68+,69+/m0/s1 SXCAQTAHLMDLNJ-KXFHBGLFSA-N 312982 US9605022, Example 15 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 0.300 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312982 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312982&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106681 383539931 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603752 COC(=O)[C@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]2[C@@H](CCN2C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)OC(C)(C)C)C(C)(C)C)n2cc(COc3ccc(C[C@H](NC(=O)[C@H](Cc4ccc5ccccc5c4)NC(=O)[C@@H]4[C@@H](CCN4C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)OC(C)(C)C)C(C)(C)C)n4cc(COc5ccc1cc5)nn4)C#N)cc3)nn2 InChI=1S/C90H111N17O16/c1-52(102(15)85(117)122-89(9,10)11)76(108)96-74(87(3,4)5)82(114)104-40-38-69-72(104)80(112)93-67(45-55-26-30-57-22-18-20-24-60(57)42-55)78(110)92-62(47-91)44-54-28-34-65(35-29-54)120-50-63-48-106(100-98-63)70-39-41-105(83(115)75(88(6,7)8)97-77(109)53(2)103(16)86(118)123-90(12,13)14)73(70)81(113)94-68(46-56-27-31-58-23-19-21-25-61(58)43-56)79(111)95-71(84(116)119-17)59-32-36-66(37-33-59)121-51-64-49-107(69)101-99-64/h18-37,42-43,48-49,52-53,62,67-75H,38-41,44-46,50-51H2,1-17H3,(H,92,110)(H,93,112)(H,94,113)(H,95,111)(H,96,108)(H,97,109)/t52-,53-,62-,67-,68-,69+,70+,71-,72?,73-,74+,75+/m0/s1 AQTZITKPGZRNPV-GBSPMIQWSA-N 312987 US9605022, Example 16 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2.20 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312987 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312987&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118428896 383539936 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603754 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)c2nc(=S)o[nH]2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C 312988 US9605022, Example 17 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 0.800 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312988 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312988&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106682 383539937 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603755 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)c2nc(=S)o[nH]2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C 312989 US9605022, Example 18 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2.20 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312989 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312989&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106683 383539938 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603757 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)c2nc(=O)o[nH]2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C 312990 US9605022, Example 19 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 0.400 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312990 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312990&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106684 383539939 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 603759 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H]2[C@H]1C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1ccc(OCc3cn(nn3)[C@@H]3CCN([C@@H]3C(=O)N[C@@H](Cc3ccc4ccccc4c3)C(=O)N[C@@H](Cc3ccc(OCc4cn2nn4)cc3)c2nc(=O)o[nH]2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(O)=O)C(C)(C)C 312991 US9605022, Example 20 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2.90 US Patent 10.7270/Q2959KMN aid1796416 US9605022 Borzilleri, RM; Zhang, Y; Miller, M; Fraley, A Ensemble Therapeutics Corp http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=312991 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=312991&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138106685 383539940 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681567 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)CCc1ccc(cc1)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C65H86N10O8/c1-38(66-9)57(77)72-55(64(3,4)5)62(82)74-36-45-33-46(31-30-44(45)34-52(74)60(80)70-50-23-15-19-41-17-11-13-21-48(41)50)69-59(79)43-28-25-40(26-29-43)27-32-54(76)68-47-35-53(61(81)71-51-24-16-20-42-18-12-14-22-49(42)51)75(37-47)63(83)56(65(6,7)8)73-58(78)39(2)67-10/h11-14,17-18,21-22,25-26,28-31,33,38-39,47,50-53,55-56,66-67H,15-16,19-20,23-24,27,32,34-37H2,1-10H3,(H,68,76)(H,69,79)(H,70,80)(H,71,81)(H,72,77)(H,73,78)/t38-,39-,47-,50+,51+,52-,53-,55+,56+/m0/s1 HBAIJECFJKLGEI-YKAQSNEXSA-N 345159 (S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-7-(4-(3-(((3S,5S)- 1-((S)-3,3-dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-5-(((R)-1,2,3,4- tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidin-3- yl)amino)-3-oxopropyl)benzamido)-N-((R)-1,2,3,4- tetrahydronaphthalen-1-yl)-1,2,3,4- tetrahydroisoquinoline-3-carboxamide::US9783573, Example 9 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 260 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345159&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73506218 385451222 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681573 CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(cc3)C(=O)Nc3ccc4C[C@H](N(Cc4c3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC(C)c3ccccc3F)ccc2C[C@H]1C(=O)NC(C)c1ccccc1F)C(C)(C)C InChI=1S/C64H78F2N10O8/c1-35(47-17-13-15-19-49(47)65)69-59(81)51-31-41-25-27-45(29-43(41)33-75(51)61(83)53(63(5,6)7)73-55(77)37(3)67-11)71-57(79)39-21-23-40(24-22-39)58(80)72-46-28-26-42-32-52(60(82)70-36(2)48-18-14-16-20-50(48)66)76(34-44(42)30-46)62(84)54(64(8,9)10)74-56(78)38(4)68-12/h13-30,35-38,51-54,67-68H,31-34H2,1-12H3,(H,69,81)(H,70,82)(H,71,79)(H,72,80)(H,73,77)(H,74,78)/t35?,36?,37-,38-,51-,52-,53+,54+/m0/s1 HCIJWALQGPLBEB-XMVXTKETSA-N 345162 N1,N4-bis((S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-3- (((R)-1-(2-fluorophenyl)ethyl)carbamoyl)- 1,2,3,4-tetrahydroisoquinolin-7- yl)terephthalamide::US9783573, Example 12 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2000 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345162 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345162&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961776 385451225 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681577 CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(cc3)C(=O)Nc3ccc4C[C@H](N(Cc4c3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC(COC)c3ccccc3)ccc2C[C@H]1C(=O)NC(COC)c1ccccc1)C(C)(C)C InChI=1S/C66H84N10O10/c1-39(67-9)57(77)73-55(65(3,4)5)63(83)75-35-47-31-49(29-27-45(47)33-53(75)61(81)71-51(37-85-11)41-19-15-13-16-20-41)69-59(79)43-23-25-44(26-24-43)60(80)70-50-30-28-46-34-54(62(82)72-52(38-86-12)42-21-17-14-18-22-42)76(36-48(46)32-50)64(84)56(66(6,7)8)74-58(78)40(2)68-10/h13-32,39-40,51-56,67-68H,33-38H2,1-12H3,(H,69,79)(H,70,80)(H,71,81)(H,72,82)(H,73,77)(H,74,78)/t39-,40-,51?,52?,53-,54-,55+,56+/m0/s1 XPTXHABMKLUTIY-KBAUTRCZSA-N 345164 N1,N4-bis((S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-3- (((R)-2-methoxy-1-phenylethyl)carbamoyl)- 1,2,3,4-tetrahydroisoquinolin-7- yl)terephthalamide::US9783573, Example 14 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2000 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345164 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345164&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961777 385451227 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681579 CC[C@H](NC)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(cc3)C(=O)N[C@H]3C[C@H](N(C3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC3CCCc4ccccc34)ccc2C[C@H]1C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C64H84N10O8/c1-11-48(66-10)58(78)72-54(64(6,7)8)61(81)73-35-43-32-44(31-30-42(43)33-51(73)59(79)69-49-24-16-20-38-18-12-14-22-46(38)49)67-56(76)40-26-28-41(29-27-40)57(77)68-45-34-52(60(80)70-50-25-17-21-39-19-13-15-23-47(39)50)74(36-45)62(82)53(63(3,4)5)71-55(75)37(2)65-9/h12-15,18-19,22-23,26-32,37,45,48-54,65-66H,11,16-17,20-21,24-25,33-36H2,1-10H3,(H,67,76)(H,68,77)(H,69,79)(H,70,80)(H,71,75)(H,72,78)/t37-,45-,48-,49?,50?,51-,52-,53+,54+/m0/s1 WYXHJJMQPDPGGU-HTCNLZEBSA-N 345165 N1-((S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)butanamido)butanoyl)-3-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)-1,2,3,4-tetrahydroisoquinolin- 7-yl)-N4-((3S,5S)-1-((S)-3,3-dimethyl-2-((S)- 2-(methylamino)propanamido)butanoyl)-5- (((R)-1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)terephthalamide::US9783573, Example 15 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 220 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345165 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345165&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118504451 385451228 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681581 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)C(F)(F)C(F)(F)C(F)(F)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C60H78F6N10O8/c1-32(67-9)48(77)73-46(56(3,4)5)52(81)75-30-37-27-38(26-25-36(37)28-44(75)50(79)71-42-23-15-19-34-17-11-13-21-40(34)42)69-54(83)58(61,62)60(65,66)59(63,64)55(84)70-39-29-45(51(80)72-43-24-16-20-35-18-12-14-22-41(35)43)76(31-39)53(82)47(57(6,7)8)74-49(78)33(2)68-10/h11-14,17-18,21-22,25-27,32-33,39,42-47,67-68H,15-16,19-20,23-24,28-31H2,1-10H3,(H,69,83)(H,70,84)(H,71,79)(H,72,80)(H,73,77)(H,74,78)/t32-,33-,39-,42?,43?,44-,45-,46+,47+/m0/s1 QPEYDHPWFLBNLA-PQZODOBESA-N 345166 US9783573, Example 16 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 320 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345166 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345166&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961778 385451229 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681583 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)C(F)(F)C(F)(F)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C59H78F4N10O8/c1-32(64-9)48(74)70-46(56(3,4)5)52(78)72-30-37-27-38(26-25-36(37)28-44(72)50(76)68-42-23-15-19-34-17-11-13-21-40(34)42)66-54(80)58(60,61)59(62,63)55(81)67-39-29-45(51(77)69-43-24-16-20-35-18-12-14-22-41(35)43)73(31-39)53(79)47(57(6,7)8)71-49(75)33(2)65-10/h11-14,17-18,21-22,25-27,32-33,39,42-47,64-65H,15-16,19-20,23-24,28-31H2,1-10H3,(H,66,80)(H,67,81)(H,68,76)(H,69,77)(H,70,74)(H,71,75)/t32-,33-,39-,42?,43?,44-,45-,46+,47+/m0/s1 KAHNQMZNNBFFEQ-PQZODOBESA-N 345167 US9783573, Example 17 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 110 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345167 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345167&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961779 385451230 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681587 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)CNc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C57H80N10O7/c1-33(58-9)50(69)64-48(56(3,4)5)54(73)66-31-38-27-39(26-25-37(38)28-45(66)52(71)62-43-23-15-19-35-17-11-13-21-41(35)43)60-30-47(68)61-40-29-46(53(72)63-44-24-16-20-36-18-12-14-22-42(36)44)67(32-40)55(74)49(57(6,7)8)65-51(70)34(2)59-10/h11-14,17-18,21-22,25-27,33-34,40,43-46,48-49,58-60H,15-16,19-20,23-24,28-32H2,1-10H3,(H,61,68)(H,62,71)(H,63,72)(H,64,69)(H,65,70)/t33-,34-,40-,43?,44?,45-,46-,48+,49+/m0/s1 GPKBDHHTTCGIAO-QSPBPXMSSA-N 345169 US9783573, Example 19 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 180 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345169&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961781 385451232 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681603 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(NC(=O)c2ccc3C[C@H](N(Cc3c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC2CCCc3ccccc23)cc1)C(C)(C)C InChI=1S/C63H82N10O8/c1-36(64-9)54(74)70-52(62(3,4)5)60(80)72-34-43-31-42(26-25-41(43)32-50(72)58(78)68-48-23-15-19-38-17-11-13-21-46(38)48)57(77)66-44-29-27-40(28-30-44)56(76)67-45-33-51(59(79)69-49-24-16-20-39-18-12-14-22-47(39)49)73(35-45)61(81)53(63(6,7)8)71-55(75)37(2)65-10/h11-14,17-18,21-22,25-31,36-37,45,48-53,64-65H,15-16,19-20,23-24,32-35H2,1-10H3,(H,66,77)(H,67,76)(H,68,78)(H,69,79)(H,70,74)(H,71,75)/t36-,37-,45?,48?,49?,50-,51-,52+,53+/m0/s1 USERKMPOWCIHLQ-WTXFRZPCSA-N 345177 US9783573, Example 27 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 120 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345177 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345177&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961783 385451240 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681605 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)C1(CC1)NC(=O)c1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C60H82N10O8/c1-34(61-9)50(71)66-48(58(3,4)5)55(76)69-32-40-29-39(26-25-38(40)30-46(69)53(74)64-44-23-15-19-36-17-11-13-21-42(36)44)52(73)68-60(27-28-60)57(78)63-41-31-47(54(75)65-45-24-16-20-37-18-12-14-22-43(37)45)70(33-41)56(77)49(59(6,7)8)67-51(72)35(2)62-10/h11-14,17-18,21-22,25-26,29,34-35,41,44-49,61-62H,15-16,19-20,23-24,27-28,30-33H2,1-10H3,(H,63,78)(H,64,74)(H,65,75)(H,66,71)(H,67,72)(H,68,73)/t34-,35-,41-,44+,45+,46-,47-,48+,49+/m0/s1 UEANYVMOHVPPNC-LPWRHJBZSA-N 345178 (S)-2-((S)-3,3-Dimethyl-2-((S)-2-(methylamino) propanamido)butanoyl)-N7-(1-(((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino)propanamido) butanoyl)-5-(((R)-1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)carbamoyl)cyclopropyl)- N3((R)-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2,3,4- tetrahydroisoquinoline-3,7-dicarboxamide::US9783573, Example 28 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 900 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345178&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73504106 385451241 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681607 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)C(C)(C)NC(=O)c1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C60H84N10O8/c1-34(61-11)50(71)66-48(58(3,4)5)55(76)69-32-40-29-39(28-27-38(40)30-46(69)53(74)64-44-25-17-21-36-19-13-15-23-42(36)44)52(73)68-60(9,10)57(78)63-41-31-47(54(75)65-45-26-18-22-37-20-14-16-24-43(37)45)70(33-41)56(77)49(59(6,7)8)67-51(72)35(2)62-12/h13-16,19-20,23-24,27-29,34-35,41,44-49,61-62H,17-18,21-22,25-26,30-33H2,1-12H3,(H,63,78)(H,64,74)(H,65,75)(H,66,71)(H,67,72)(H,68,73)/t34-,35-,41-,44+,45+,46-,47-,48+,49+/m0/s1 USRMQGZFCDUGRL-LPWRHJBZSA-N 345179 (S)-2-((S)-3,3-Dimethyl-2-((S)-2-(methylamino) propanamido)butanoyl)-N7-(1-(((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino)propanamido) butanoyl)-5-(((R)-1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)amino)-2-methyl-1- oxopropan-2-yl)-N3-((R)-1,2,3,4-tetrahydronaphthalen- 1-yl)-1,2,3,4-tetrahydroisoquinoline-3,7-dicarboxamide::US9783573, Example 29 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 180 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345179&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497878 385451242 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681609 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CO[C@@H]2CCN([C@@H](C2)C(=O)NC2CCCc3ccccc23)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C59H83N9O8/c1-35(60-9)51(69)65-49(58(3,4)5)56(74)67-30-29-42(32-48(67)55(73)64-46-24-16-20-39-18-12-14-22-44(39)46)76-34-37-25-27-40(28-26-37)53(71)62-41-31-47(54(72)63-45-23-15-19-38-17-11-13-21-43(38)45)68(33-41)57(75)50(59(6,7)8)66-52(70)36(2)61-10/h11-14,17-18,21-22,25-28,35-36,41-42,45-50,60-61H,15-16,19-20,23-24,29-34H2,1-10H3,(H,62,71)(H,63,72)(H,64,73)(H,65,69)(H,66,70)/t35-,36-,41?,42+,45?,46?,47-,48-,49+,50+/m0/s1 CPBUAUBYAKLKOK-HAHYJMHBSA-N 345180 US9783573, Example 30 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 110 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345180&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961784 385451243 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681611 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CNc2ccc3C[C@H](N(Cc3c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC2CCCc3ccccc23)cc1)C(C)(C)C InChI=1S/C63H84N10O7/c1-37(64-9)55(74)70-53(62(3,4)5)60(79)72-35-44-31-45(30-29-43(44)32-51(72)58(77)68-49-23-15-19-40-17-11-13-21-47(40)49)66-34-39-25-27-42(28-26-39)57(76)67-46-33-52(59(78)69-50-24-16-20-41-18-12-14-22-48(41)50)73(36-46)61(80)54(63(6,7)8)71-56(75)38(2)65-10/h11-14,17-18,21-22,25-31,37-38,46,49-54,64-66H,15-16,19-20,23-24,32-36H2,1-10H3,(H,67,76)(H,68,77)(H,69,78)(H,70,74)(H,71,75)/t37-,38-,46?,49?,50?,51-,52-,53+,54+/m0/s1 FQDRXYPGOKPIKX-GKSNKUOISA-N 345181 US9783573, Example 31 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 520 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345181&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961785 385451244 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681613 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CN(C(C)=O)c2ccc3C[C@H](N(Cc3c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC2CCCc3ccccc23)cc1)C(C)(C)C InChI=1S/C65H86N10O8/c1-38(66-10)57(77)71-55(64(4,5)6)62(82)74-36-46-32-48(31-30-45(46)33-53(74)60(80)69-51-24-16-20-42-18-12-14-22-49(42)51)73(40(3)76)35-41-26-28-44(29-27-41)59(79)68-47-34-54(61(81)70-52-25-17-21-43-19-13-15-23-50(43)52)75(37-47)63(83)56(65(7,8)9)72-58(78)39(2)67-11/h12-15,18-19,22-23,26-32,38-39,47,51-56,66-67H,16-17,20-21,24-25,33-37H2,1-11H3,(H,68,79)(H,69,80)(H,70,81)(H,71,77)(H,72,78)/t38-,39-,47?,51?,52?,53-,54-,55+,56+/m0/s1 SUSFWURNJMTUGZ-LOKLLDKISA-N 345182 US9783573, Example 32 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 110 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345182&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961786 385451245 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681615 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(CNc2ccc3C[C@H](N(Cc3c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC2CCCc3ccccc23)c(Cl)c1)C(C)(C)C InChI=1S/C63H83ClN10O7/c1-36(65-9)55(75)71-53(62(3,4)5)60(80)73-34-43-29-44(28-27-40(43)31-51(73)58(78)69-49-23-15-19-38-17-11-13-21-46(38)49)67-33-42-26-25-41(30-48(42)64)57(77)68-45-32-52(59(79)70-50-24-16-20-39-18-12-14-22-47(39)50)74(35-45)61(81)54(63(6,7)8)72-56(76)37(2)66-10/h11-14,17-18,21-22,25-30,36-37,45,49-54,65-67H,15-16,19-20,23-24,31-35H2,1-10H3,(H,68,77)(H,69,78)(H,70,79)(H,71,75)(H,72,76)/t36-,37-,45?,49?,50?,51-,52-,53+,54+/m0/s1 XQSIBUBOFPOXKS-MKUNCAPJSA-N 345183 US9783573, Example 33 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 790 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345183&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961787 385451246 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681617 CCN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(cc3)C(=O)NC3CC(N(C3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC3CCCc4ccccc34)ccc2CC1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C64H84N10O8/c1-11-66-38(3)56(76)72-53(63(4,5)6)61(81)73-35-44-32-45(31-30-43(44)33-51(73)59(79)69-49-24-16-20-39-18-12-14-22-47(39)49)67-57(77)41-26-28-42(29-27-41)58(78)68-46-34-52(60(80)70-50-25-17-21-40-19-13-15-23-48(40)50)74(36-46)62(82)54(64(7,8)9)71-55(75)37(2)65-10/h12-15,18-19,22-23,26-32,37-38,46,49-54,65-66H,11,16-17,20-21,24-25,33-36H2,1-10H3,(H,67,77)(H,68,78)(H,69,79)(H,70,80)(H,71,75)(H,72,76)/t37-,38-,46?,49+,50?,51?,52?,53+,54+/m0/s1 FIHIJMZKMXZYNS-GEDFJSBOSA-N 345184 N1-((3S,5S)-1-((S)-3,3-dimethyl- 2-((S)-2-(methylamino) propanamido)butanoyl)-5-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)-N4- ((S)-2-((S)-2-((S)-2-(ethylamino) propanamido)-3,3- dimethylbutanoyl)-3-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7- yl)terephthalamide::US9783573, Example 34 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 410 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345184&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961788 385451247 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681619 CCN[C@@H](C(C)C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(cc3)C(=O)NC3CC(N(C3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC3CCCc4ccccc34)ccc2CC1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C66H88N10O8/c1-12-68-54(38(2)3)62(82)74-56(66(8,9)10)63(83)75-36-45-33-46(32-31-44(45)34-52(75)60(80)71-50-25-17-21-40-19-13-15-23-48(40)50)69-58(78)42-27-29-43(30-28-42)59(79)70-47-35-53(61(81)72-51-26-18-22-41-20-14-16-24-49(41)51)76(37-47)64(84)55(65(5,6)7)73-57(77)39(4)67-11/h13-16,19-20,23-24,27-33,38-39,47,50-56,67-68H,12,17-18,21-22,25-26,34-37H2,1-11H3,(H,69,78)(H,70,79)(H,71,80)(H,72,81)(H,73,77)(H,74,82)/t39-,47?,50+,51?,52?,53?,54-,55+,56+/m0/s1 YNRMEYBKGZVJQF-PPQBKDOFSA-N 345185 N1-(3S,5S)-1-((S)-3,3-dimethyl- 2-((S)-2-(methylamino) propanamido)butanoyl)-5-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)-N4- ((S)-2-((S)-3,3-dimethyl-2-((S)-3- methyl-2-(methylamino) butanamido)butanoyl)-3-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7- yl)terephthalamide::US9783573, Example 35 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1400 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345185&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961789 385451248 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681621 CCN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(cc3)C(=O)NC3CC(N(C3)C(=O)[C@@H](NC(=O)[C@@H](NC)C(C)C)C(C)(C)C)C(=O)NC3CCCc4ccccc34)ccc2CC1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C66H88N10O8/c1-12-68-39(4)57(77)73-55(65(5,6)7)63(83)75-36-45-33-46(32-31-44(45)34-52(75)60(80)71-50-25-17-21-40-19-13-15-23-48(40)50)69-58(78)42-27-29-43(30-28-42)59(79)70-47-35-53(61(81)72-51-26-18-22-41-20-14-16-24-49(41)51)76(37-47)64(84)56(66(8,9)10)74-62(82)54(67-11)38(2)3/h13-16,19-20,23-24,27-33,38-39,47,50-56,67-68H,12,17-18,21-22,25-26,34-37H2,1-11H3,(H,69,78)(H,70,79)(H,71,80)(H,72,81)(H,73,77)(H,74,82)/t39-,47?,50+,51?,52?,53?,54-,55+,56+/m0/s1 JWXXLHIYUTWEMB-PPQBKDOFSA-N 345186 N1-((S)-2-((S)-3,3-dimethyl-2- ((S)-2-(methylamino) propanamido)butanoyl)-3-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7-yl)-N4- ((3S,5S)-1-((S)-3,3-dimethyl-2- ((S)-3-methyl-2-(methylamino) butanamido)butanoyl)-5-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)terephthalamide::US9783573, Example 36 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1900 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345186&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961790 385451249 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681623 CN[C@@H](C)C(=O)N[C@H](C(=O)[C@@H]1CC(CN1C(=O)NC1CCCc2ccccc12)NC(=O)[C@@H](CCC(F)(F)F)[C@@H](CCC(F)(F)F)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C65H88F6N10O8/c1-36(72-9)55(83)78-53(62(3,4)5)52(82)50-33-43(35-81(50)61(89)77-49-24-16-20-39-18-12-14-22-45(39)49)75-58(86)47(28-30-65(69,70)71)46(27-29-64(66,67)68)57(85)74-42-26-25-40-32-51(59(87)76-48-23-15-19-38-17-11-13-21-44(38)48)80(34-41(40)31-42)60(88)54(63(6,7)8)79-56(84)37(2)73-10/h11-14,17-18,21-22,25-26,31,36-37,43,46-51,53-54,72-73H,15-16,19-20,23-24,27-30,32-35H2,1-10H3,(H,74,85)(H,75,86)(H,76,87)(H,77,89)(H,78,83)(H,79,84)/t36-,37-,43?,46+,47-,48?,49?,50-,51-,53+,54+/m0/s1 QBLMRKIWHODMAB-FRNOIQALSA-N 345187 (2S,3R)-N1-((3S,5S)-5-((S)-3,3- dimethyl-2-((S)-2-(methylamino) propanamido)butanoyl)-1-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)-N4- ((S)-2-((S)-3,3-dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-3-(((R)-1,2,3,4- tetrahydronaphthalen-1- yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7-yl)-2,3- bis(3,3,3-trifluoropropyl) succinamide::US9783573, Example 37 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 290 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345187&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961791 385451250 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681629 CCN[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1Cc2cc(OCc3ccc(cc3)C(=O)NC3CC(N(C3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC3CCCc4ccccc34)ccc2CC1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C)C(C)(C)C InChI=1S/C70H96N10O9/c1-14-72-42(3)61(82)76-57(68(4,5)6)65(86)78-59(70(10,11)12)66(87)79-38-48-35-50(34-33-47(48)36-55(79)63(84)74-53-27-19-23-44-21-15-17-25-51(44)53)89-40-43-29-31-46(32-30-43)62(83)73-49-37-56(64(85)75-54-28-20-24-45-22-16-18-26-52(45)54)80(39-49)67(88)58(69(7,8)9)77-60(81)41(2)71-13/h15-18,21-22,25-26,29-35,41-42,49,53-59,71-72H,14,19-20,23-24,27-28,36-40H2,1-13H3,(H,73,83)(H,74,84)(H,75,85)(H,76,82)(H,77,81)(H,78,86)/t41-,42-,49?,53+,54?,55?,56?,57+,58+,59+/m0/s1 KMBWECOKLHQPRE-TUPBNSROSA-N 345190 (S)-7-((4-(((3S,5S)-1-((S)-3,3- Dimethyl-2-((S)-2-(methylamino) propanamido)butanoyl)-5-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)carbamoyl)benzyl)oxy)-2-((S)- 2-((S)-2-((S)-2-(ethylamino) propanamido)-3,3- dimethylbutanamido)-3,3- dimethylbutanoyl)-N-((R)-1,2,3,4- tetrahydronaphthalen-1-yl)- 1,2,3,4-tetrahydroisoquinoline-3- carboxamide::US9783573, Example 40 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 2100 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345190&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961793 385451253 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681631 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(COc2ccc3CN([C@@H](Cc3c2)C(=O)NC2CCCc3ccccc23)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C63H83N9O8/c1-37(64-9)55(73)69-53(62(3,4)5)60(78)71-34-43-29-30-46(31-44(43)32-51(71)58(76)67-49-23-15-19-40-17-11-13-21-47(40)49)80-36-39-25-27-42(28-26-39)57(75)66-45-33-52(59(77)68-50-24-16-20-41-18-12-14-22-48(41)50)72(35-45)61(79)54(63(6,7)8)70-56(74)38(2)65-10/h11-14,17-18,21-22,25-31,37-38,45,49-54,64-65H,15-16,19-20,23-24,32-36H2,1-10H3,(H,66,75)(H,67,76)(H,68,77)(H,69,73)(H,70,74)/t37-,38-,45-,49?,50?,51-,52-,53+,54+/m0/s1 MHUDJHSFECRQLB-RHNBJTJLSA-N 345191 (S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-6-((4-(((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-5-(((R)-1,2,3,4- tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)carbamoyl)benzyl)oxy)-N-((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)-1,2,3,4-tetrahydroisoquinoline- 3-carboxamide::US9783573, Example 41 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 290 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345191&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961794 385451254 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681633 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)c1ccc(COc2ccc3CN([C@H](Cc3c2)C(=O)NC2CCCc3ccccc23)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)cc1)C(C)(C)C InChI=1S/C63H83N9O8/c1-37(64-9)55(73)69-53(62(3,4)5)60(78)71-34-43-29-30-46(31-44(43)32-51(71)58(76)67-49-23-15-19-40-17-11-13-21-47(40)49)80-36-39-25-27-42(28-26-39)57(75)66-45-33-52(59(77)68-50-24-16-20-41-18-12-14-22-48(41)50)72(35-45)61(79)54(63(6,7)8)70-56(74)38(2)65-10/h11-14,17-18,21-22,25-31,37-38,45,49-54,64-65H,15-16,19-20,23-24,32-36H2,1-10H3,(H,66,75)(H,67,76)(H,68,77)(H,69,73)(H,70,74)/t37-,38-,45-,49?,50?,51+,52-,53+,54+/m0/s1 MHUDJHSFECRQLB-CUTNUHKBSA-N 345192 (R)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-6-((4-(((3S,5S)-1-((S)- 3,3-dimethyl-2-((5)-2- (methylamino)propanamido) butanoyl)-5-(((R)-1,2,3,4- tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)carbamoyl)benzyl)oxy)-N-((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)-1,2,3,4-tetrahydroisoquinoline- 3-carboxamide::US9783573, Example 42 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 1300 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345192&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961795 385451255 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681635 CC[C@H](NC)C(=O)N[C@H](C(=O)N1Cc2cc(OCc3ccc(cc3)C(=O)N[C@H]3C[C@H](N(C3)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]3CCCc4ccccc34)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C64H85N9O8/c1-11-49(66-10)58(76)71-55(64(6,7)8)61(79)72-35-44-32-46(31-30-43(44)33-52(72)59(77)68-50-24-16-20-40-18-12-14-22-47(40)50)81-37-39-26-28-42(29-27-39)57(75)67-45-34-53(60(78)69-51-25-17-21-41-19-13-15-23-48(41)51)73(36-45)62(80)54(63(3,4)5)70-56(74)38(2)65-9/h12-15,18-19,22-23,26-32,38,45,49-55,65-66H,11,16-17,20-21,24-25,33-37H2,1-10H3,(H,67,75)(H,68,77)(H,69,78)(H,70,74)(H,71,76)/t38-,45-,49-,50+,51+,52-,53-,54+,55+/m0/s1 YLQHRUUGXBXOPC-NBHXLWSESA-N 345193 S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)butanamido) butanoyl)-7-((4-(((3S,5S)-1-((S)- 3,3-dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-5-(((R)-1,2,3,4- tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)carbamoyl)benzyl)oxy)-N-((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)-1,2,3,4-tetrahydroisoquinoline- 3-carboxamide::US9783573, Example 43 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 700 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345193&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497987 385451256 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681637 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C#Cc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C64H81N9O7/c1-38(65-9)56(74)70-54(63(3,4)5)61(79)72-36-46-33-41(29-32-45(46)34-52(72)59(77)68-50-23-15-19-42-17-11-13-21-48(42)50)26-25-40-27-30-44(31-28-40)58(76)67-47-35-53(60(78)69-51-24-16-20-43-18-12-14-22-49(43)51)73(37-47)62(80)55(64(6,7)8)71-57(75)39(2)66-10/h11-14,17-18,21-22,27-33,38-39,47,50-55,65-66H,15-16,19-20,23-24,34-37H2,1-10H3,(H,67,76)(H,68,77)(H,69,78)(H,70,74)(H,71,75)/t38-,39-,47-,50+,51+,52-,53-,54+,55+/m0/s1 MZOKCLGAIIRHDG-KHFWCYFCSA-N 50030275 CHEMBL3339216::US9783573, Example 44 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 740 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50030275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50030275&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 90089572 103939232 CHEMBL3339216 ZINC04475245 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681639 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CCc2ccc3C[C@H](N(Cc3c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]2CCCc3ccccc23)cc1)C(C)(C)C InChI=1S/C64H85N9O7/c1-38(65-9)56(74)70-54(63(3,4)5)61(79)72-36-46-33-41(29-32-45(46)34-52(72)59(77)68-50-23-15-19-42-17-11-13-21-48(42)50)26-25-40-27-30-44(31-28-40)58(76)67-47-35-53(60(78)69-51-24-16-20-43-18-12-14-22-49(43)51)73(37-47)62(80)55(64(6,7)8)71-57(75)39(2)66-10/h11-14,17-18,21-22,27-33,38-39,47,50-55,65-66H,15-16,19-20,23-26,34-37H2,1-10H3,(H,67,76)(H,68,77)(H,69,78)(H,70,74)(H,71,75)/t38-,39-,47-,50+,51+,52-,53-,54+,55+/m0/s1 MRQUIOMXZIGPPW-KHFWCYFCSA-N 50030273 CHEMBL3339217::US9783573, Example 45 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 960 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50030273 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50030273&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 90089737 103939230 CHEMBL3339217 ZINC34932074 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681641 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(cc1)C(=O)Oc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C63H81N9O9/c1-36(64-9)54(73)69-52(62(3,4)5)59(78)71-34-43-31-45(30-29-42(43)32-50(71)57(76)67-48-23-15-19-38-17-11-13-21-46(38)48)81-61(80)41-27-25-40(26-28-41)56(75)66-44-33-51(58(77)68-49-24-16-20-39-18-12-14-22-47(39)49)72(35-44)60(79)53(63(6,7)8)70-55(74)37(2)65-10/h11-14,17-18,21-22,25-31,36-37,44,48-53,64-65H,15-16,19-20,23-24,32-35H2,1-10H3,(H,66,75)(H,67,76)(H,68,77)(H,69,73)(H,70,74)/t36-,37-,44-,48+,49+,50-,51-,52+,53+/m0/s1 VCQYNJLUQOHBQN-RKYLDKKZSA-N 345196 US9783573, Example 46 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 190 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345196&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497931 385451259 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681643 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)OCc1ccc(cc1)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C63H83N9O8/c1-37(64-9)55(73)69-53(62(3,4)5)60(78)71-34-44-31-45(30-29-43(44)32-51(71)58(76)67-49-23-15-19-40-17-11-13-21-47(40)49)66-57(75)42-27-25-39(26-28-42)36-80-46-33-52(59(77)68-50-24-16-20-41-18-12-14-22-48(41)50)72(35-46)61(79)54(63(6,7)8)70-56(74)38(2)65-10/h11-14,17-18,21-22,25-31,37-38,46,49-54,64-65H,15-16,19-20,23-24,32-36H2,1-10H3,(H,66,75)(H,67,76)(H,68,77)(H,69,73)(H,70,74)/t37-,38-,46-,49+,50+,51-,52-,53+,54+/m0/s1 GBSJCHIETXINLY-AZDADDNRSA-N 345197 US9783573, Example 47 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 130 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345197&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 90089585 385451260 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681645 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)OCc1ccc(cc1)C(=O)Oc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C63H82N8O9/c1-37(64-9)55(72)68-53(62(3,4)5)59(76)70-34-44-31-45(30-29-43(44)32-51(70)57(74)66-49-23-15-19-40-17-11-13-21-47(40)49)80-61(78)42-27-25-39(26-28-42)36-79-46-33-52(58(75)67-50-24-16-20-41-18-12-14-22-48(41)50)71(35-46)60(77)54(63(6,7)8)69-56(73)38(2)65-10/h11-14,17-18,21-22,25-31,37-38,46,49-54,64-65H,15-16,19-20,23-24,32-36H2,1-10H3,(H,66,74)(H,67,75)(H,68,72)(H,69,73)/t37-,38-,46-,49+,50+,51-,52-,53+,54+/m0/s1 AHHUNRGEEKTKTO-AZDADDNRSA-N 345198 US9783573, Example 48 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 500 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345198&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 90089605 385451261 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681649 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)OCc1ccc(cc1)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@H](C)c1ccccc1F)C(C)(C)C InChI=1S/C61H80FN9O8/c1-35(45-19-14-15-21-47(45)62)65-56(75)49-30-41-27-28-43(29-42(41)32-70(49)58(77)51(60(4,5)6)68-53(72)36(2)63-10)66-55(74)40-25-23-38(24-26-40)34-79-44-31-50(57(76)67-48-22-16-18-39-17-12-13-20-46(39)48)71(33-44)59(78)52(61(7,8)9)69-54(73)37(3)64-11/h12-15,17,19-21,23-29,35-37,44,48-52,63-64H,16,18,22,30-34H2,1-11H3,(H,65,75)(H,66,74)(H,67,76)(H,68,72)(H,69,73)/t35-,36+,37+,44+,48-,49+,50+,51-,52-/m1/s1 VUUPAYFAZGRMOV-REEQQHIYSA-N 345200 (S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-7-(4-((((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino) propanamido)butanoyl)-5-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)oxy)methyl)benzamido)-N-((R)-1- (2-fluorophenyl)ethyl)-1,2,3,4- tetrahydroisoquinoline-3-carboxamide::US9783573, Example 50 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 610 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345200&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497924 385451263 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681653 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)OCc1cccc(c1)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C63H83N9O8/c1-37(64-9)55(73)69-53(62(3,4)5)60(78)71-34-44-31-45(29-28-42(44)32-51(71)58(76)67-49-26-16-21-40-19-11-13-24-47(40)49)66-57(75)43-23-15-18-39(30-43)36-80-46-33-52(59(77)68-50-27-17-22-41-20-12-14-25-48(41)50)72(35-46)61(79)54(63(6,7)8)70-56(74)38(2)65-10/h11-15,18-20,23-25,28-31,37-38,46,49-54,64-65H,16-17,21-22,26-27,32-36H2,1-10H3,(H,66,75)(H,67,76)(H,68,77)(H,69,73)(H,70,74)/t37-,38-,46-,49+,50+,51-,52-,53+,54+/m0/s1 DPHNGGGFYKHOKV-AZDADDNRSA-N 345202 (S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-7-(3-((((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino) propanamido)butanoyl)-5-(((R)- 1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3- yl)oxy)methyl)benzamido)-N-((R)- 1,2,3,4-tetrahydronaphthalen-1-yl)- 1,2,3,4-tetrahydroisoquinoline-3- carboxamide::US9783573, Example 52 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 360 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345202&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497912 385451265 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681655 CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)n1ccc2ccc(cc12)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C65H83N11O8/c1-37(66-9)56(77)72-54(64(3,4)5)61(82)75-35-44-31-45(28-27-42(44)32-52(75)59(80)70-49-23-15-19-39-17-11-13-21-47(39)49)68-58(79)43-26-25-41-29-30-74(51(41)33-43)63(84)69-46-34-53(60(81)71-50-24-16-20-40-18-12-14-22-48(40)50)76(36-46)62(83)55(65(6,7)8)73-57(78)38(2)67-10/h11-14,17-18,21-22,25-31,33,37-38,46,49-50,52-55,66-67H,15-16,19-20,23-24,32,34-36H2,1-10H3,(H,68,79)(H,69,84)(H,70,80)(H,71,81)(H,72,77)(H,73,78)/t37-,38-,46?,49?,50?,52-,53-,54+,55+/m0/s1 SAOLJERBTRGSIJ-OLLRURIWSA-N 345203 N6-((3S)-2-((S)-3,3-Dimethyl-2-((S)- 2-(methylamino)propanamido) butanoyl)-3-((1,2,3,4- tetrahydronaphthalen-1- yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7-yl)-N1-((5S)- 1-((S)-3,3-dimethyl-2-((S)-2- (methylamino)propanamido) butanoyl)-5-((1,2,3,4- tetrahydronaphthalen-1-yl)carbamoyl) pyrrolidin-3-yl)-1H-indole-1,6- dicarboxamide::US9783573, Example 53 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 250 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345203&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497948 385451266 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681551 CN[C@@H](C)C(=C)N[C@H](C(=O)C1CC(C[C@H]1C(=O)NC1CCCc2ccccc12)NC(=O)CCC(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)NC1CCCc2ccccc12)C(C)(C)C InChI=1S/C61H85N9O7/c1-35(62-10)36(2)64-54(60(4,5)6)53(73)46-32-43(33-47(46)57(75)67-48-24-16-20-38-18-12-14-22-44(38)48)66-52(72)29-28-51(71)65-42-27-26-40-31-50(58(76)68-49-25-17-21-39-19-13-15-23-45(39)49)70(34-41(40)30-42)59(77)55(61(7,8)9)69-56(74)37(3)63-11/h12-15,18-19,22-23,26-27,30,35,37,43,46-50,54-55,62-64H,2,16-17,20-21,24-25,28-29,31-34H2,1,3-11H3,(H,65,71)(H,66,72)(H,67,75)(H,68,76)(H,69,74)/t35-,37-,43?,46?,47+,48?,49?,50-,54+,55+/m0/s1 JDWUZMFALDSKKW-NVSALGDVSA-N 345151 US9783573, Example 1 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 96.0 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345151&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 138961774 385451214 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681555 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)CCCC(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C60H84N10O8/c1-35(61-9)53(73)67-51(59(3,4)5)57(77)69-33-40-30-41(29-28-39(40)31-47(69)55(75)65-45-24-15-20-37-18-11-13-22-43(37)45)63-49(71)26-17-27-50(72)64-42-32-48(56(76)66-46-25-16-21-38-19-12-14-23-44(38)46)70(34-42)58(78)52(60(6,7)8)68-54(74)36(2)62-10/h11-14,18-19,22-23,28-30,35-36,42,45-48,51-52,61-62H,15-17,20-21,24-27,31-34H2,1-10H3,(H,63,71)(H,64,72)(H,65,75)(H,66,76)(H,67,73)(H,68,74)/t35-,36-,42-,45+,46+,47-,48-,51+,52+/m0/s1 NQARVPNPYPHNOD-MLOMWMBNSA-N 50071850 CHEMBL3410808::US9783573, Example 3 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 72.0 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50071850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50071850&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497874 103965560 CHEMBL3410808 ZINC26639078 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681557 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)N(C(=O)C1(CC1)C(N)=O)c1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C60H82N10O8/c1-34(62-9)50(71)66-48(58(3,4)5)54(75)68-32-39-29-40(26-25-38(39)30-46(68)52(73)64-44-23-15-19-36-17-11-13-21-42(36)44)70(57(78)60(27-28-60)56(61)77)41-31-47(53(74)65-45-24-16-20-37-18-12-14-22-43(37)45)69(33-41)55(76)49(59(6,7)8)67-51(72)35(2)63-10/h11-14,17-18,21-22,25-26,29,34-35,41,44-49,62-63H,15-16,19-20,23-24,27-28,30-33H2,1-10H3,(H2,61,77)(H,64,73)(H,65,74)(H,66,71)(H,67,72)/t34-,35-,41-,44+,45+,46-,47-,48+,49+/m0/s1 LGPGGDOPUHMXKG-LPWRHJBZSA-N 345154 N-((S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-3-(((R)-1,2,3,4- tetrahydronaphthalen-1-yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7-yl)-N-((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)- 5-(((R)-1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)cyclopropane-1,1- dicarboxamide::US9783573, Example 4 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 150 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345154&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497957 385451217 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681559 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)N(C(=O)C1(CCC1)C(N)=O)c1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C61H84N10O8/c1-35(63-9)51(72)67-49(59(3,4)5)55(76)69-33-40-30-41(27-26-39(40)31-47(69)53(74)65-45-24-15-20-37-18-11-13-22-43(37)45)71(58(79)61(57(62)78)28-17-29-61)42-32-48(54(75)66-46-25-16-21-38-19-12-14-23-44(38)46)70(34-42)56(77)50(60(6,7)8)68-52(73)36(2)64-10/h11-14,18-19,22-23,26-27,30,35-36,42,45-50,63-64H,15-17,20-21,24-25,28-29,31-34H2,1-10H3,(H2,62,78)(H,65,74)(H,66,75)(H,67,72)(H,68,73)/t35-,36-,42-,45+,46+,47-,48-,49+,50+/m0/s1 VORKKKQKFBVOFA-PRXWBPHPSA-N 345155 N-((S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-3-(((R)-1,2,3,4- tetrahydronaphthalen-1-yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7-yl)-N-((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)- 5-(((R)-1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)cyclobutane-1,1- dicarboxamide::US9783573, Example 5 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 100.0 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345155&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 118497977 385451218 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681563 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)C1CC2(C1)CC(C2)C(=O)Nc1ccc2C[C@H](N(Cc2c1)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C InChI=1S/C64H88N10O8/c1-36(65-9)54(75)71-52(62(3,4)5)60(81)73-34-41-27-44(26-25-40(41)28-50(73)58(79)69-48-23-15-19-38-17-11-13-21-46(38)48)67-56(77)42-30-64(31-42)32-43(33-64)57(78)68-45-29-51(59(80)70-49-24-16-20-39-18-12-14-22-47(39)49)74(35-45)61(82)53(63(6,7)8)72-55(76)37(2)66-10/h11-14,17-18,21-22,25-27,36-37,42-43,45,48-53,65-66H,15-16,19-20,23-24,28-35H2,1-10H3,(H,67,77)(H,68,78)(H,69,79)(H,70,80)(H,71,75)(H,72,76)/t36-,37-,42?,43?,45-,48+,49+,50-,51-,52+,53+,64?/m0/s1 SPBAFUFNQDTHRY-QDVJPDANSA-N 345157 N2-((S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-3-(((R)-1,2,3,4- tetrahydronaphthalen-1-yl)carbamoyl)-1,2,3,4- tetrahydroisoquinolin-7-yl)-N6-((3S,5S)-1-((S)-3,3- dimethyl-2-((S)-2-(methylamino)propanamido)butanoyl)- 5-(((R)-1,2,3,4-tetrahydronaphthalen-1- yl)carbamoyl)pyrrolidin-3-yl)spiro[3.3]heptane-2,6- dicarboxamide::US9783573, Example 7 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 120 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345157&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73506005 385451220 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0 681565 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H](C[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)NC(=O)c1ccc(CCC(=O)Nc2ccc3C[C@H](N(Cc3c2)C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C(=O)N[C@@H]2CCCc3ccccc23)cc1)C(C)(C)C InChI=1S/C65H86N10O8/c1-38(66-9)57(77)72-55(64(3,4)5)62(82)74-36-45-33-46(31-30-44(45)34-52(74)60(80)70-50-23-15-19-41-17-11-13-21-48(41)50)68-54(76)32-27-40-25-28-43(29-26-40)59(79)69-47-35-53(61(81)71-51-24-16-20-42-18-12-14-22-49(42)51)75(37-47)63(83)56(65(6,7)8)73-58(78)39(2)67-10/h11-14,17-18,21-22,25-26,28-31,33,38-39,47,50-53,55-56,66-67H,15-16,19-20,23-24,27,32,34-37H2,1-10H3,(H,68,76)(H,69,79)(H,70,80)(H,71,81)(H,72,77)(H,73,78)/t38-,39-,47-,50+,51+,52-,53-,55+,56+/m0/s1 KDEVTDVUTDFKMU-YKAQSNEXSA-N 345158 (S)-2-((S)-3,3-Dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-7-(3-(4-(((3S,5S)- 1-((S)-3,3-dimethyl-2-((S)-2- (methylamino)propanamido)butanoyl)-5-(((R)-1,2,3,4- tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidin-3- yl)carbamoyl)phenyl)propanamido)-N-((R)-1,2,3,4- tetrahydronaphthalen-1-yl)-1,2,3,4- tetrahydroisoquinoline-3-carboxamide::US9783573, Example 8 Baculoviral IAP repeat-containing protein 2/E3 ubiquitin-protein ligase XIAP 99.0 US Patent 10.7270/Q24B33FH aid1797279 US9783573 Borzilleri, RM; Kim, KS; Perez, HL; Stang, EM; Williams, DK; Zhang, L Bristol-Myers Squibb Co. http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=345158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=com&complexid=167&target=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=345158&enzyme=Baculoviral+IAP+repeat-containing+protein+2%2FE3+ubiquitin-protein+ligase+XIAP&column=ki&startPg=0&Increment=50&submit=Search 73506006 385451221 2 MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS 1F9X,1G3F,1G73,1I4O,1NW9,1TFQ,1TFT,2JK7,2KNA,2OPY,2OPZ,2POI,2POP,2QRA,2VSL,4HY0,4IC2,4MTZ,4OXC,5O6T,6GJW,6QCI,8AZA,8GH7 E3 ubiquitin-protein ligase XIAP XIAP_HUMAN P98170 D3DTF2 Q9NQ14 MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGVPVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSASLGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYAMSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEHRRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGRNDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLLSTSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTTGENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILDNLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLFVDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLRKCPICRGIIKGTVRTFLS 1QBH,3D9T,3D9U,3M1D,4KMN,5M6N,6HPR,6W74,6W7O,6W8I,7NK0,7TRL,7TRM,8DSF,8DSO Baculoviral IAP repeat-containing protein 2 BIRC2_HUMAN Q13490 B4E026 Q16516 Q4TTG0