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Target
Integrase
Ligand
BDBM50477469
Substrate
n/a
Meas. Tech.
ChEMBL_455147 (CHEMBL887177)
IC50
20000±n/a nM
Citation
 Sriram, D; Yogeeswari, P; Senchani, G; Banerjee, D Newer tetracycline derivatives: synthesis, anti-HIV, antimycobacterial activities and inhibition of HIV-1 integrase. Bioorg Med Chem Lett 17:2372-5 (2007) [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:
BDBM50477469
Synonyms:
CHEMBL396907
Type:
Small organic molecule
Emp. Form.:
C39H42FN5O11
Mol. Mass.:
775.7761
SMILES:
[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CC1)c1cc3n(CC)cc(C(O)=O)c(=O)c3cc1F)=C(O)[C@H]2N(C)C |t:19,57|
Structure:
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