BDBM50012952 2-Hydroxy-3-[3-(1H-imidazol-4-yl)-2-(4-morpholin-4-yl-2-naphthalen-1-ylmethyl-4-oxo-butyrylamino)-propionylamino]-4-phenyl-butyric acid isopropyl ester::CHEMBL330093
SMILES: CC(C)OC(=O)C(O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](CC(=O)N1CCOCC1)Cc1cccc2ccccc12
InChI Key: InChIKey=XYGPJCYTYWXAFA-BNCKCNCLSA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Renin (Homo sapiens (Human)) | BDBM50012952 (2-Hydroxy-3-[3-(1H-imidazol-4-yl)-2-(4-morpholin-4...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Company, Ltd. Curated by ChEMBL | Assay Description Tested for inhibition of human plasma renin | J Med Chem 33: 2707-14 (1990) BindingDB Entry DOI: 10.7270/Q2N29XJZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Renin (Homo sapiens (Human)) | BDBM50012952 (2-Hydroxy-3-[3-(1H-imidazol-4-yl)-2-(4-morpholin-4...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Company, Ltd. Curated by ChEMBL | Assay Description Tested for inhibition of renin from human | J Med Chem 33: 2707-14 (1990) BindingDB Entry DOI: 10.7270/Q2N29XJZ | |||||||||||
More data for this Ligand-Target Pair |