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Target
Integrase
Ligand
BDBM50000036
Substrate
n/a
Meas. Tech.
ChEMBL_90875 (CHEMBL699308)
IC50
290±n/a nM
Citation
 Nicklaus, MC; Neamati, N; Hong, H; Mazumder, A; Sunder, S; Chen, J; Milne, GW; Pommier, Y HIV-1 integrase pharmacophore: discovery of inhibitors through three-dimensional database searching. J Med Chem 40:920-9 (1997) [PubMed]  Article 
Target
Name:
Integrase
Synonyms:
Human immunodeficiency virus type 1 integrase
Type:
PROTEIN
Mol. Mass.:
32231.48
Organism:
Human immunodeficiency virus type 1
Description:
ChEMBL_90865
Residue:
288
Sequence:
FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSNFTSTTVKAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPLWKGPAKLLWKGEGAVVIQDNSDIKVVPRRKVKIIRDYGKQMAGDDCVASRQDED
  
Inhibitor
Name:
BDBM50000036
Synonyms:
4-ACETYLAMINO-5-HYDROXYNAPHTHALENE-2,7-DISULFONIC ACID | 4-Acetylamino-5-hydroxy-naphthalene-2,7-disulfonic acid | 4-Acetylamino-5-hydroxy-naphthalene-2,7-disulfonic acid; sodium salt | CHEMBL144613 | HIV-1 Integrase Inhibitor
Type:
Small organic molecule
Emp. Form.:
C12H11NO8S2
Mol. Mass.:
361.348
SMILES:
CC(=O)Nc1cc(cc2cc(cc(O)c12)S(O)(=O)=O)S(O)(=O)=O
Structure:
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