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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin receptor ET-A' and Monomerid = 50034267   
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 receptor ET-A


(Mus musculus)
BDBM50034267
PNG
(3-(benzo[d][1,3]dioxol-5-yl)-5-hydroxy-5-(4-methox...)
Show SMILES COc1ccc(cc1)C1(O)OC(=O)C(=C1Cc1cc(OC)c(OC)c(OC)c1)c1ccc2OCOc2c1
Show InChI InChI=1/C28H26O9/c1-31-19-8-6-18(7-9-19)28(30)20(11-16-12-23(32-2)26(34-4)24(13-16)33-3)25(27(29)37-28)17-5-10-21-22(14-17)36-15-35-21/h5-10,12-14,30H,11,15H2,1-4H3
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PC sid
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Similars

Article
PubMed
n/an/a 0.300n/an/an/an/an/an/a



University Hospital M£nster

Curated by ChEMBL


Assay Description
Displacement of [125I]ET1 from endothelin A receptor in DBA mouse microsomes


Bioorg Med Chem 17: 7197-208 (2009)


Article DOI: 10.1016/j.bmc.2009.08.058
BindingDB Entry DOI: 10.7270/Q27S7NVF
More data for this
Ligand-Target Pair