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Target
Integrase
Ligand
BDBM50095511
Substrate
n/a
Meas. Tech.
ChEMBL_90549 (CHEMBL701899)
IC50
180±n/a nM
Citation
 Wai, JS; Egbertson, MS; Payne, LS; Fisher, TE; Embrey, MW; Tran, LO; Melamed, JY; Langford, HM; Guare, JP; Zhuang, L; Grey, VE; Vacca, JP; Holloway, MK; Naylor-Olsen, AM; Hazuda, DJ; Felock, PJ; Wolfe, AL; Stillmock, KA; Schleif, WA; Gabryelski, LJ; Young, SD 4-Aryl-2,4-dioxobutanoic acid inhibitors of HIV-1 integrase and viral replication in cells. J Med Chem 43:4923-6 (2001) [PubMed]
Target
Name:
Integrase
Synonyms:
Human immunodeficiency virus type 1 integrase
Type:
PROTEIN
Mol. Mass.:
32231.48
Organism:
Human immunodeficiency virus 1
Description:
ChEMBL_90865
Residue:
288
Sequence:
FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSNFTSTTVKAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPLWKGPAKLLWKGEGAVVIQDNSDIKVVPRRKVKIIRDYGKQMAGDDCVASRQDED
  
Inhibitor
Name:
BDBM50095511
Synonyms:
4-(2-Benzyl-thiophen-3-yl)-2,4-dioxo-butyric acid | CHEMBL197638 | CHEMBL359212
Type:
Small organic molecule
Emp. Form.:
C15H12O4S
Mol. Mass.:
288.318
SMILES:
OC(=O)C(=O)CC(=O)c1ccsc1Cc1ccccc1
Structure:
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