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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 = 'BDBM50291489'   
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))
BDBM50291489
PNG
(3-[2-(2,4,6-Trimethyl-phenyl)-ethyl]-thiophene-2-s...)
Show SMILES Cc1noc(NS(=O)(=O)c2sccc2CCc2c(C)cc(C)cc2C)c1Br
Show InChI InChI=1S/C19H21BrN2O3S2/c1-11-9-12(2)16(13(3)10-11)6-5-15-7-8-26-19(15)27(23,24)22-18-17(20)14(4)21-25-18/h7-10,22H,5-6H2,1-4H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents


Similars

Article
n/an/a 58n/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