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BDBM50288271 3-p-Tolyl-thiophene-2-sulfonic acid (4-bromo-3-methyl-isoxazol-5-yl)-amide::CHEMBL91073

SMILES: Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(C)cc2)c1Br

InChI Key: InChIKey=LTECCECZZZMLGF-UHFFFAOYSA-N

Data: 2 IC50

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 = 50288271   
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
EDNRB


(Homo sapiens (Human))
BDBM50288271
PNG
(3-p-Tolyl-thiophene-2-sulfonic acid (4-bromo-3-met...)
Show SMILES Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(C)cc2)c1Br
Show InChI InChI=1S/C15H13BrN2O3S2/c1-9-3-5-11(6-4-9)12-7-8-22-15(12)23(19,20)18-14-13(16)10(2)17-21-14/h3-8,18H,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 9.56E+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
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50288271
PNG
(3-p-Tolyl-thiophene-2-sulfonic acid (4-bromo-3-met...)
Show SMILES Cc1noc(NS(=O)(=O)c2sccc2-c2ccc(C)cc2)c1Br
Show InChI InChI=1S/C15H13BrN2O3S2/c1-9-3-5-11(6-4-9)12-7-8-22-15(12)23(19,20)18-14-13(16)10(2)17-21-14/h3-8,18H,1-2H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 316n/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