Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM26985
Substrate
n/a
Meas. Tech.
ChEMBL_717766 (CHEMBL1671440)
IC50
1200±n/a nM
Citation
 Bodiwala, HS; Sabde, S; Gupta, P; Mukherjee, R; Kumar, R; Garg, P; Bhutani, KK; Mitra, D; Singh, IP Design and synthesis of caffeoyl-anilides as portmanteau inhibitors of HIV-1 integrase and CCR5. Bioorg Med Chem 19:1256-63 (2011) [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:
BDBM26985
Synonyms:
2-triaza-1,2-diyne | CHEMBL79455 | CHEMBL89295 | N3(-1) | azide
Type:
Ion
Emp. Form.:
N3
Mol. Mass.:
42.0206
SMILES:
[N-]=[N+]=[N-]
Structure:
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