Reaction Details Report a problem with these data
Target
E3 ubiquitin-protein ligase XIAP
Ligand
BDBM44292
Substrate
n/a
Meas. Tech.
SAR analysis of Antagonists of IAP-family anti-apoptotic proteins
IC50
41000±4100 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:
BDBM44292
Synonyms:
MLS-0391027.0001 | benzyl (2S)-1-[(2S)-4-methoxy-2-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carboxylate;formic acid | cid_44182154 | formic acid;(2S)-1-[(2S)-4-keto-4-methoxy-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidine-2-carboxylic acid benzyl ester | formic acid;(2S)-1-[(2S)-4-methoxy-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester | methanoic acid;(phenylmethyl) (2S)-1-[(2S)-4-methoxy-2-[[(2S)-2-(methylamino)propanoyl]amino]-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate
Type:
Small organic molecule
Emp. Form.:
C21H29N3O6
Mol. Mass.:
419.4715
SMILES:
CN[C@@H](C)C(=O)N[C@@H](CC(=O)OC)C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1
Structure:
Search PDB for entries with ligand similarity: