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Target
Integrase
Ligand
BDBM50176129
Substrate
n/a
Meas. Tech.
ChEMBL_321311 (CHEMBL881407)
IC50
40±n/a nM
Citation
 Barreca, ML; Ferro, S; Rao, A; De Luca, L; Zappalà, M; Monforte, AM; Debyser, Z; Witvrouw, M; Chimirri, A Pharmacophore-based design of HIV-1 integrase strand-transfer inhibitors. J Med Chem 48:7084-8 (2005) [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:
BDBM50176129
Synonyms:
CHEMBL380588 | N-[7-(4-Fluoro-benzylcarbamoyl)-8-hydroxy-[1,6]naphthyridin-5-yl]-oxalamide
Type:
Small organic molecule
Emp. Form.:
C18H14FN5O4
Mol. Mass.:
383.3333
SMILES:
NC(=O)C(=O)Nc1nc(C(=O)NCc2ccc(F)cc2)c(O)c2ncccc12
Structure:
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