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BDBM50109661 4'-(1H-Imidazol-2-yl)-biphenyl-2-sulfonic acid (3,4-dimethyl-isoxazol-5-yl)-amide::CHEMBL148855

SMILES: Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(cc2)-c2ncc[nH]2)c1C

InChI Key: InChIKey=FNTMFRCZIVZTGK-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50109661   
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-1 receptor


(Homo sapiens (Human))
BDBM50109661
PNG
(4'-(1H-Imidazol-2-yl)-biphenyl-2-sulfonic acid (3,...)
Show SMILES Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(cc2)-c2ncc[nH]2)c1C
Show InChI InChI=1S/C20H18N4O3S/c1-13-14(2)23-27-20(13)24-28(25,26)18-6-4-3-5-17(18)15-7-9-16(10-8-15)19-21-11-12-22-19/h3-12,24H,1-2H3,(H,21,22)
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
44n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to CHO cells stably expressing human Endothelin A receptor.


Bioorg Med Chem Lett 12: 517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2GF0STQ
More data for this
Ligand-Target Pair
EDNRB


(Homo sapiens (Human))
BDBM50109661
PNG
(4'-(1H-Imidazol-2-yl)-biphenyl-2-sulfonic acid (3,...)
Show SMILES Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(cc2)-c2ncc[nH]2)c1C
Show InChI InChI=1S/C20H18N4O3S/c1-13-14(2)23-27-20(13)24-28(25,26)18-6-4-3-5-17(18)15-7-9-16(10-8-15)19-21-11-12-22-19/h3-12,24H,1-2H3,(H,21,22)
PDB

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
1.50E+5n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to CHO cells stably expressing human Endothelin B receptor.


Bioorg Med Chem Lett 12: 517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2GF0STQ
More data for this
Ligand-Target Pair