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BDBM50034457 5-(Isopropyl-methyl-amino)-naphthalene-1-sulfonic acid (3,4-dimethyl-isoxazol-5-yl)-amide::CHEMBL283652

SMILES: CC(C)N(C)c1cccc2c(cccc12)S(=O)(=O)Nc1onc(C)c1C

InChI Key: InChIKey=DXCOFYZOPGIJTO-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50034457   
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
EDNRA


(RAT)
BDBM50034457
PNG
(5-(Isopropyl-methyl-amino)-naphthalene-1-sulfonic ...)
Show SMILES CC(C)N(C)c1cccc2c(cccc12)S(=O)(=O)Nc1onc(C)c1C
Show InChI InChI=1S/C19H23N3O3S/c1-12(2)22(5)17-10-6-9-16-15(17)8-7-11-18(16)26(23,24)21-19-13(3)14(4)20-25-19/h6-12,21H,1-5H3
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KEGG

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 4n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of [125I]-endothelin-l binding to endothelin A receptor of rat thoracic aorta smooth muscle cells


J Med Chem 38: 659-68 (1995)


BindingDB Entry DOI: 10.7270/Q2D799G5
More data for this
Ligand-Target Pair
EDNRA


(RAT)
BDBM50034457
PNG
(5-(Isopropyl-methyl-amino)-naphthalene-1-sulfonic ...)
Show SMILES CC(C)N(C)c1cccc2c(cccc12)S(=O)(=O)Nc1onc(C)c1C
Show InChI InChI=1S/C19H23N3O3S/c1-12(2)22(5)17-10-6-9-16-15(17)8-7-11-18(16)26(23,24)21-19-13(3)14(4)20-25-19/h6-12,21H,1-5H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 130n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Antagonism of [125 I]ET-1 binding to the rat endothelin receptor in vascular smooth muscle VSM-A10 cells.


J Med Chem 38: 1344-54 (1995)


BindingDB Entry DOI: 10.7270/Q20864BS
More data for this
Ligand-Target Pair