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BDBM50288272 4-Phenyl-thiophene-2-sulfonic acid (4-bromo-3-methyl-isoxazol-5-yl)-amide::CHEMBL329375

SMILES: Cc1noc(NS(=O)(=O)c2cc(cs2)-c2ccccc2)c1Br

InChI Key: InChIKey=NXWRCHOPXGTIMB-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50288272   
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))
BDBM50288272
PNG
(4-Phenyl-thiophene-2-sulfonic acid (4-bromo-3-meth...)
Show SMILES Cc1noc(NS(=O)(=O)c2cc(cs2)-c2ccccc2)c1Br
Show InChI InChI=1S/C14H11BrN2O3S2/c1-9-13(15)14(20-16-9)17-22(18,19)12-7-11(8-21-12)10-5-3-2-4-6-10/h2-8,17H,1H3
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Article
n/an/a 3.39E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for binding affinity against Endothelin A receptor


Bioorg Med Chem Lett 6: 2651-2656 (1996)


Article DOI: 10.1016/S0960-894X(96)00496-9
BindingDB Entry DOI: 10.7270/Q24M94HV
More data for this
Ligand-Target Pair
EDNRB


(Homo sapiens (Human))
BDBM50288272
PNG
(4-Phenyl-thiophene-2-sulfonic acid (4-bromo-3-meth...)
Show SMILES Cc1noc(NS(=O)(=O)c2cc(cs2)-c2ccccc2)c1Br
Show InChI InChI=1S/C14H11BrN2O3S2/c1-9-13(15)14(20-16-9)17-22(18,19)12-7-11(8-21-12)10-5-3-2-4-6-10/h2-8,17H,1H3
PDB

Reactome pathway

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
n/an/a 1.35E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for binding affinity against Endothelin B receptor


Bioorg Med Chem Lett 6: 2651-2656 (1996)


Article DOI: 10.1016/S0960-894X(96)00496-9
BindingDB Entry DOI: 10.7270/Q24M94HV
More data for this
Ligand-Target Pair