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Target
Integrase
Ligand
BDBM50477993
Substrate
n/a
Meas. Tech.
ChEMBL_463501 (CHEMBL932796)
IC50
5.0±n/a nM
Citation
 Dayam, R; Al-Mawsawi, LQ; Zawahir, Z; Witvrouw, M; Debyser, Z; Neamati, N Quinolone 3-carboxylic acid pharmacophore: design of second generation HIV-1 integrase inhibitors. J Med Chem 51:1136-44 (2008) [PubMed]  Article 
Target
Name:
Integrase
Synonyms:
pol
Type:
PROTEIN
Mol. Mass.:
32203.43
Organism:
Human immunodeficiency virus 1
Description:
ChEMBL_106649
Residue:
288
Sequence:
FLDGIDKAQEEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEFGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPVWKGPAKLLWKGEGAVVIQDNSDIKVVPRRKAKIIRDYGKQMAGDDCVASRQDED
  
Inhibitor
Name:
BDBM50477993
Synonyms:
CHEMBL406595
Type:
Small organic molecule
Emp. Form.:
C15H9Cl2N3O4S
Mol. Mass.:
398.221
SMILES:
Nc1c(sc2[nH]c(=O)c(cc12)C(O)=O)C(=O)Nc1ccc(Cl)c(Cl)c1
Structure:
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