Target
E3 ubiquitin-protein ligase XIAP
Ligand
BDBM44368
Substrate
n/a
Meas. Tech.
SAR analysis of Antagonists of XIAP-Bir3 domain of IAP-family anti-apoptotic proteins
IC50
62300±500 nM
Citation
 PubChem, PC SAR analysis of Antagonists of XIAP-Bir3 domain 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:
BDBM44368
Synonyms:
(2S)-N-[(3S)-1-[2-[(3,4-dichlorophenyl)hydrazo]-2-oxoethyl]-2-oxo-3-azepanyl]-2-(methylamino)propanamide;formic acid | (2S)-N-[(3S)-1-[2-[2-(3,4-dichlorophenyl)hydrazinyl]-2-oxidanylidene-ethyl]-2-oxidanylidene-azepan-3-yl]-2-(methylamino)propanamide;methanoic acid | (2S)-N-[(3S)-1-[2-[2-(3,4-dichlorophenyl)hydrazinyl]-2-oxoethyl]-2-oxoazepan-3-yl]-2-(methylamino)propanamide;formic acid | (2S)-N-[(3S)-1-[2-[N'-(3,4-dichlorophenyl)hydrazino]-2-keto-ethyl]-2-keto-azepan-3-yl]-2-(methylamino)propionamide;formic acid | MLS-0412071.0001 | cid_44182189
Type:
Small organic molecule
Emp. Form.:
C18H25Cl2N5O3
Mol. Mass.:
430.329
SMILES:
CN[C@@H](C)C(=O)N[C@H]1CCCCN(CC(=O)NNc2ccc(Cl)c(Cl)c2)C1=O
Structure:
Search PDB for entries with ligand similarity: