Reaction Details |
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Target | Baculoviral IAP repeat-containing protein 2 |
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Ligand | BDBM50078359 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1470757 (CHEMBL3420986) |
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IC50 | 3.0±n/a nM |
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Citation | Seigal, BA; Connors, WH; Fraley, A; Borzilleri, RM; Carter, PH; Emanuel, SL; Fargnoli, J; Kim, K; Lei, M; Naglich, JG; Pokross, ME; Posy, SL; Shen, H; Surti, N; Talbott, R; Zhang, Y; Terrett, NK The discovery of macrocyclic XIAP antagonists from a DNA-programmed chemistry library, and their optimization to give lead compounds with in vivo antitumor activity. J Med Chem58:2855-61 (2015) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Baculoviral IAP repeat-containing protein 2 |
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Name: | Baculoviral IAP repeat-containing protein 2 |
Synonyms: | API1 | BIRC2 | BIRC2_HUMAN | Baculoviral IAP repeat-containing protein 2 (cIAP1) | Cellular inhibitor of apoptosis 1 | Inhibitor of apoptosis protein 2 (cIAP1) | MIHB | RNF48 |
Type: | Protein |
Mol. Mass.: | 69900.47 |
Organism: | Homo sapiens (Human) |
Description: | Q13490 |
Residue: | 618 |
Sequence: | MHKTASQRLFPGPSYQNIKSIMEDSTILSDWTNSNKQKMKYDFSCELYRMSTYSTFPAGV
PVSERSLARAGFYYTGVNDKVKCFCCGLMLDNWKLGDSPIQKHKQLYPSCSFIQNLVSAS
LGSTSKNTSPMRNSFAHSLSPTLEHSSLFSGSYSSLSPNPLNSRAVEDISSSRTNPYSYA
MSTEEARFLTYHMWPLTFLSPSELARAGFYYIGPGDRVACFACGGKLSNWEPKDDAMSEH
RRHFPNCPFLENSLETLRFSISNLSMQTHAARMRTFMYWPSSVPVQPEQLASAGFYYVGR
NDDVKCFCCDGGLRCWESGDDPWVEHAKWFPRCEFLIRMKGQEFVDEIQGRYPHLLEQLL
STSDTTGEENADPPIIHFGPGESSSEDAVMMNTPVVKSALEMGFNRDLVKQTVQSKILTT
GENYKTVNDIVSALLNAEDEKREEEKEKQAEEMASDDLSLIRKNRMALFQQLTCVLPILD
NLLKANVINKQEHDIIKQKTQIPLQARELIDTILVKGNAAANIFKNCLKEIDSTLYKNLF
VDKNMKYIPTEDVSGLSLEEQLRRLQEERTCKVCMDKEVSVVFIPCGHLVVCQECAPSLR
KCPICRGIIKGTVRTFLS
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BDBM50078359 |
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n/a |
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Name | BDBM50078359 |
Synonyms: | CHEMBL3414729 |
Type | Small organic molecule |
Emp. Form. | C64H80N16O12 |
Mol. Mass. | 1265.42 |
SMILES | [H][C@@]12CN(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C)[C@@]([H])(C1)C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1cn(nn1)[C@]1([H])CN(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C)[C@@]([H])(C1)C(=O)N[C@@H](Cc1ccc3ccccc3c1)C(=O)N[C@@H](Cc1cn2nn1)C(O)=O)C(O)=O |r| |
Structure |
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