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SMILES: COc1ccc(cc1)C(\O)=C\C(=O)c1nnn(Cc2cccc(F)c2)c1C

InChI Key: InChIKey=IKYABUSWAIBSCR-WQRHYEAKSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50484525   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Integrase


(Human immunodeficiency virus 1)		BDBM50484525
PNG
(CHEMBL1928162)
Show SMILES COc1ccc(cc1)C(\O)=C\C(=O)c1nnn(Cc2cccc(F)c2)c1C
Show InChI InChI=1S/C20H18FN3O3/c1-13-20(22-23-24(13)12-14-4-3-5-16(21)10-14)19(26)11-18(25)15-6-8-17(27-2)9-7-15/h3-11,25H,12H2,1-2H3/b18-11-
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.40E+4n/an/an/an/an/an/a



Beijing University of Technology

Curated by ChEMBL


Assay Description
Inhibition of Human immunodeficiency virus 1 integrase-mediated strand transfer activity after 1 hr

Bioorg Med Chem 20: 177-82 (2012)


Article DOI: 10.1016/j.bmc.2011.11.014
BindingDB Entry DOI: 10.7270/Q2NP278N
More data for this
Ligand-Target Pair