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Target
Integrase
Ligand
BDBM50181144
Substrate
n/a
Meas. Tech.
ChEMBL_346056 (CHEMBL862316)
IC50
10000±n/a nM
Citation
 Nair, V; Uchil, V; Neamati, N Beta-diketo acids with purine nucleobase scaffolds: novel, selective inhibitors of the strand transfer step of HIV integrase. Bioorg Med Chem Lett 16:1920-3 (2006) [PubMed]  Article 
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:
BDBM50181144
Synonyms:
(Z)-4-(9-benzyl-9H-purin-8-yl)-2-hydroxy-4-oxobut-2-enoic acid | CHEMBL206980
Type:
Small organic molecule
Emp. Form.:
C16H12N4O4
Mol. Mass.:
324.2909
SMILES:
OC(=O)C(=O)CC(=O)c1nc2cncnc2n1Cc1ccccc1
Structure:
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