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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50187185'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Integrase


(Human immunodeficiency virus 1)		BDBM50187185
PNG
(7-(4-fluorobenzyl)-9-hydroxy-5-methoxy-6-methylene...)
Show SMILES COc1c2C(=C)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
Show InChI InChI=1S/C20H15FN2O3/c1-11-15-16(18(24)17-14(19(15)26-2)4-3-9-22-17)20(25)23(11)10-12-5-7-13(21)8-6-12/h3-9,24H,1,10H2,2H3
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MMDB

UniProtKB/TrEMBL

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PC cid
PC sid
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Patents

Similars
Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Gilead Sciences

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase strand transfer activity in MT4 cell line

Bioorg Med Chem Lett 16: 4031-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.008
BindingDB Entry DOI: 10.7270/Q2QR4WRV
More data for this
Ligand-Target Pair