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Target
E3 ubiquitin-protein ligase XIAP
Ligand
BDBM44322
Substrate
n/a
Meas. Tech.
SAR analysis of Antagonists of IAP-family anti-apoptotic proteins
IC50
48100±300 nM
Citation
 PubChem, PC SAR analysis of Antagonists of IAP-family anti-apoptotic proteins PubChem Bioassay (2009)[AID] 
Target
Name:
E3 ubiquitin-protein ligase XIAP
Synonyms:
API3 | BIRC4 | E3 ubiquitin-protein ligase XIAP | IAP3 | Inhibitor of apoptosis protein 3 | Inhibitor of apoptosis protein 3 (XIAP) | X-linked inhibitor of apoptosis | X-linked inhibitor of apoptosis protein (XIAP) | XIAP | XIAP_HUMAN
Type:
Protein
Mol. Mass.:
56685.27
Organism:
Homo sapiens (Human)
Description:
P98170
Residue:
497
Sequence:
MTFNSFEGSKTCVPADINKEEEFVEEFNRLKTFANFPSGSPVSASTLARAGFLYTGEGDTVRCFSCHAAVDRWQYGDSAVGRHRKVSPNCRFINGFYLENSATQSTNSGIQNGQYKVENYLGSRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPDYAHLTPRELASAGLYYTGIGDQVQCFCCGGKLKNWEPCDRAWSEHRRHFPNCFFVLGRNLNIRSESDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTTEKTPSLTRRIDDTIFQNPMVQEAIRMGFSFKDIKKIMEEKIQISGSNYKSLEVLVADLVNAQKDSMQDESSQTSLQKEISTEEQLRRLQEEKLCKICMDRNIAIVFVPCGHLVTCKQCAEAVDKCPMCYTVITFKQKIFMS
  
Inhibitor
Name:
BDBM44322
Synonyms:
MLS-0412157.0001 | cid_44182231 | formic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxo-1-[(2R)-1-oxo-1-(2-phenylhydrazinyl)propan-2-yl]azepan-3-yl]propanamide | formic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxo-1-[(2R)-1-oxo-1-(phenylhydrazo)propan-2-yl]-3-azepanyl]propanamide | formic acid;(2S)-N-[(3S)-2-keto-1-[(1R)-2-keto-1-methyl-2-(N'-phenylhydrazino)ethyl]azepan-3-yl]-2-(methylamino)propionamide | methanoic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxidanylidene-1-[(2R)-1-oxidanylidene-1-(2-phenylhydrazinyl)propan-2-yl]azepan-3-yl]propanamide
Type:
Small organic molecule
Emp. Form.:
C19H29N5O3
Mol. Mass.:
375.4653
SMILES:
CN[C@@H](C)C(=O)N[C@H]1CCCCN([C@H](C)C(=O)NNc2ccccc2)C1=O
Structure:
Search PDB for entries with ligand similarity: