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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Renin' and Ligand = 'BDBM50329025'   
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
Renin


(Homo sapiens (Human))		BDBM50329025
PNG
((1-cyclopentyl-2-(3-fluoro-2-methylbenzyl)-1H-indo...)
Show SMILES Cc1c(F)cccc1Cc1c(C(=O)N2CCNCC2)c2ccccc2n1C1CCCC1
Show InChI InChI=1S/C26H30FN3O/c1-18-19(7-6-11-22(18)27)17-24-25(26(31)29-15-13-28-14-16-29)21-10-4-5-12-23(21)30(24)20-8-2-3-9-20/h4-7,10-12,20,28H,2-3,8-9,13-17H2,1H3
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n/an/a 20n/an/an/an/an/an/a



Sanofi-Aventis Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibition of human recombinant renin using flurorogenic substrate by microplate spectrofluorometer

Bioorg Med Chem Lett 20: 6268-72 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.092
BindingDB Entry DOI: 10.7270/Q2VH5P2M
More data for this
Ligand-Target Pair