Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM50536083
Substrate
n/a
Meas. Tech.
ChEMBL_1932792 (CHEMBL4478444)
IC50
>100000±n/a nM
Citation
 Wu, B; Tang, J; Wilson, DJ; Huber, AD; Casey, MC; Ji, J; Kankanala, J; Xie, J; Sarafianos, SG; Wang, Z 3-Hydroxypyrimidine-2,4-dione-5-N-benzylcarboxamides Potently Inhibit HIV-1 Integrase and RNase H. J Med Chem 59:6136-48 (2016) [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:
BDBM50536083
Synonyms:
CHEMBL4083483
Type:
Small organic molecule
Emp. Form.:
C24H20N4O4
Mol. Mass.:
428.44
SMILES:
On1c(=O)[nH]c(Nc2ccc(cc2)-c2ccccc2)c(C(=O)NCc2ccccc2)c1=O
Structure:
Search PDB for entries with ligand similarity: