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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50014143   
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))		BDBM50014143
PNG
(6-Amino-2-(3-benzyl-8,8-dimethyl-2,5,9-trioxo-[1,4...)
Show SMILES CCC(C)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)N1C(=O)[C@H](Cc2ccccc2)NC(=O)CCC(C)(C)C1=O
Show InChI InChI=1S/C38H52N6O5/c1-5-25(2)23-41-34(46)30(22-27-24-40-29-16-10-9-15-28(27)29)43-35(47)32(17-11-12-20-39)44-36(48)31(21-26-13-7-6-8-14-26)42-33(45)18-19-38(3,4)37(44)49/h6-10,13-16,24-25,30-32,40H,5,11-12,17-23,39H2,1-4H3,(H,41,46)(H,42,45)(H,43,47)/t25?,30-,31-,32-/m0/s1
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MMDB

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PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human renin

J Med Chem 33: 2560-8 (1990)


BindingDB Entry DOI: 10.7270/Q20V8BR8
More data for this
Ligand-Target Pair