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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Angiotensin-converting enzyme' and Ligand = 'BDBM50282846'   
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
Angiotensin-converting enzyme


(Oryctolagus cuniculus)		BDBM50282846
PNG
((S)-1-[(S)-3-(1H-Indol-3-yl)-2-((S)-2-mercaptometh...)
Show SMILES OC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CS)Cc1ccccc1
Show InChI InChI=1S/C26H29N3O4S/c30-24(19(16-34)13-17-7-2-1-3-8-17)28-22(25(31)29-12-6-11-23(29)26(32)33)14-18-15-27-21-10-5-4-9-20(18)21/h1-5,7-10,15,19,22-23,27,34H,6,11-14,16H2,(H,28,30)(H,32,33)/t19-,22+,23+/m1/s1
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PC cid
PC sid
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Similars
Article
n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of rabbit lung Angiotensin I converting enzyme (ACE) using Hippuryl-His-Leu 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