BDBM50071425 CHEMBL311854::N-[(R)-1-[(S)-1-(Butane-1-sulfonylaminocarbonyl)-2-methyl-propylcarbamoyl]-2-(4-isoxazol-5-yl-phenyl)-ethyl]-3,5,N-trimethyl-benzamide
SMILES: CCCCS(=O)(=O)NC(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(cc1)-c1ccno1)N(C)C(=O)c1cc(C)cc(C)c1)C(C)C
InChI Key: InChIKey=IFLIQLQVUMXNFU-IAPPQJPRSA-N
Data: 4 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
EDNRB (Homo sapiens (Human)) | BDBM50071425 (CHEMBL311854 | N-[(R)-1-[(S)-1-(Butane-1-sulfonyla...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Takarazuka Research Institute Curated by ChEMBL | Assay Description Binding affinity to Endothelin B receptor | Bioorg Med Chem Lett 8: 2241-6 (1999) BindingDB Entry DOI: 10.7270/Q2BC3XQ7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EDNRB (Homo sapiens (Human)) | BDBM50071425 (CHEMBL311854 | N-[(R)-1-[(S)-1-(Butane-1-sulfonyla...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Takarazuka Research Institute Curated by ChEMBL | Assay Description Compound was tested for the binding affinity against Endothelin B receptor | Bioorg Med Chem Lett 8: 2247-52 (1999) BindingDB Entry DOI: 10.7270/Q26M3609 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Endothelin-1 receptor (Homo sapiens (Human)) | BDBM50071425 (CHEMBL311854 | N-[(R)-1-[(S)-1-(Butane-1-sulfonyla...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Takarazuka Research Institute Curated by ChEMBL | Assay Description Compound was tested for the binding affinity against Endothelin A receptor | Bioorg Med Chem Lett 8: 2247-52 (1999) BindingDB Entry DOI: 10.7270/Q26M3609 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Endothelin-1 receptor (Homo sapiens (Human)) | BDBM50071425 (CHEMBL311854 | N-[(R)-1-[(S)-1-(Butane-1-sulfonyla...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Takarazuka Research Institute Curated by ChEMBL | Assay Description Binding affinity to Endothelin A receptor | Bioorg Med Chem Lett 8: 2241-6 (1999) BindingDB Entry DOI: 10.7270/Q2BC3XQ7 | |||||||||||
More data for this Ligand-Target Pair |