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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50282844'   
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
Neprilysin


(Rattus norvegicus (Rat))		BDBM50282844
PNG
(1-{2-[3-(4-Benzyloxy-phenyl)-2-mercaptomethyl-prop...)
Show SMILES C[C@H](NC(=O)[C@@H](CS)Cc1ccc(OCc2ccccc2)cc1)C(=O)N1CCC[C@@H]1C(O)=O
Show InChI InChI=1S/C25H30N2O5S/c1-17(24(29)27-13-5-8-22(27)25(30)31)26-23(28)20(16-33)14-18-9-11-21(12-10-18)32-15-19-6-3-2-4-7-19/h2-4,6-7,9-12,17,20,22,33H,5,8,13-16H2,1H3,(H,26,28)(H,30,31)/t17-,20+,22+/m0/s1
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Article
n/an/a 40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of rat kidney neutral endopeptidase (NEP) by fluorometric assay using Dansyl-Gly-Phe-Arg as substrate

Bioorg Med Chem Lett 4: 1783-1788 (1994)


Article DOI: 10.1016/S0960-894X(01)80371-1
BindingDB Entry DOI: 10.7270/Q2Z3204W
More data for this
Ligand-Target Pair