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BDBM50105037 4-tert-Butyl-N-{5-(3-methoxy-phenoxy)-6-[2-(pyridin-2-yloxy)-ethoxy]-pyrimidin-4-yl}-benzenesulfonamide::CHEMBL114105

SMILES: COc1cccc(Oc2c(NS(=O)(=O)c3ccc(cc3)C(C)(C)C)ncnc2OCCOc2ccccn2)c1

InChI Key: InChIKey=ZFQMMJJQAFLPQA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50105037   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Endothelin receptor ET-A


(Sus scrofa)		BDBM50105037
PNG
(4-tert-Butyl-N-{5-(3-methoxy-phenoxy)-6-[2-(pyridi...)
Show SMILES COc1cccc(Oc2c(NS(=O)(=O)c3ccc(cc3)C(C)(C)C)ncnc2OCCOc2ccccn2)c1
Show InChI InChI=1S/C28H30N4O6S/c1-28(2,3)20-11-13-23(14-12-20)39(33,34)32-26-25(38-22-9-7-8-21(18-22)35-4)27(31-19-30-26)37-17-16-36-24-10-5-6-15-29-24/h5-15,18-19H,16-17H2,1-4H3,(H,30,31,32)
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PC sid
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Similars
PubMed
n/an/a 8.80n/an/an/an/an/an/a



Tanabe Seiyaku Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of [125I]-ET-1 binding to Endothelin A receptor in porcine aortic membrane from endothelial cells

J Med Chem 44: 3355-68 (2001)


BindingDB Entry DOI: 10.7270/Q2QN662B
More data for this
Ligand-Target Pair