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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin-1 receptor' and Ligand = 'BDBM50291484'   
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
Endothelin-1 receptor


(Homo sapiens (Human))		BDBM50291484
PNG
(3-[2-(6-Hydroxymethyl-benzo[1,3]dioxol-5-yl)-vinyl...)
Show SMILES Cc1noc(NS(=O)(=O)c2sccc2\C=C\c2cc3OCOc3cc2CO)c1Br
Show InChI InChI=1S/C18H15BrN2O6S2/c1-10-16(19)17(27-20-10)21-29(23,24)18-11(4-5-28-18)2-3-12-6-14-15(26-9-25-14)7-13(12)8-22/h2-7,21-22H,8-9H2,1H3/b3-2+
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PC sid
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Similars
Article
n/an/a 79n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory of human Endothelin A receptor by using I-ET-1 as radioligand in a competitive radioligand assay

Bioorg Med Chem Lett 7: 939-944 (1997)


Article DOI: 10.1016/S0960-894X(97)00133-9
BindingDB Entry DOI: 10.7270/Q2959HKC
More data for this
Ligand-Target Pair