BDBM50105000 CHEMBL175616::sodium salt of 4-tert-Butyl-N-[6-(2-hydroxy-ethoxy)-5-(2-methoxy-phenoxy)-[2,2']bipyrimidinyl-4-yl]-benzenesulfonamide
SMILES: COc1ccccc1Oc1c([N-]S(=O)(=O)c2ccc(cc2)C(C)(C)C)nc(nc1OCCO)-c1ncccn1
InChI Key: InChIKey=UJGUMHQLVYROSG-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
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Endothelin-1 receptor (Homo sapiens (Human)) | BDBM50105000 (CHEMBL175616 | sodium salt of 4-tert-Butyl-N-[6-(2...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | 81 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd. Curated by ChEMBL | Assay Description Ability to inhibit [125I]ET1 binding to human cloned endothelin A receptor expressed on CHO cells | J Med Chem 44: 3369-77 (2001) BindingDB Entry DOI: 10.7270/Q27M08P8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EDNRB (Homo sapiens (Human)) | BDBM50105000 (CHEMBL175616 | sodium salt of 4-tert-Butyl-N-[6-(2...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd. Curated by ChEMBL | Assay Description Ability to inhibit [125I]-ET-1 binding to human cloned ETB receptors expressed on CHO cells | J Med Chem 44: 3369-77 (2001) BindingDB Entry DOI: 10.7270/Q27M08P8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Endothelin receptor ET-A (Sus scrofa) | BDBM50105000 (CHEMBL175616 | sodium salt of 4-tert-Butyl-N-[6-(2...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 7.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd. Curated by ChEMBL | Assay Description Ability to inhibit [125I]ET1 binding to endothelin A receptor in porcine aortic membrane | J Med Chem 44: 3369-77 (2001) BindingDB Entry DOI: 10.7270/Q27M08P8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Endothelin receptor ET-A (Sus scrofa) | BDBM50105000 (CHEMBL175616 | sodium salt of 4-tert-Butyl-N-[6-(2...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 7.5 | n/a | n/a | n/a | n/a | n/a | n/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 | |||||||||||||
EDNRB (Homo sapiens (Human)) | BDBM50105000 (CHEMBL175616 | sodium salt of 4-tert-Butyl-N-[6-(2...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd. Curated by ChEMBL | Assay Description Ability to inhibit specific binding of [125I]- -ET-1 to human GH cells which express endothelin B receptor | J Med Chem 44: 3355-68 (2001) BindingDB Entry DOI: 10.7270/Q2QN662B | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EDNRA (RAT) | BDBM50105000 (CHEMBL175616 | sodium salt of 4-tert-Butyl-N-[6-(2...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Tanabe Seiyaku Co., Ltd. Curated by ChEMBL | Assay Description In vitro for specific binding of [125I]-ET-1 to A10 cell expressed in endothelin A receptor | J Med Chem 44: 3355-68 (2001) BindingDB Entry DOI: 10.7270/Q2QN662B | |||||||||||
More data for this Ligand-Target Pair |