BDBM50318882 4-(2-(4-methylpiperazin-1-yl)thiazol-4-yl)-N-(1-((3S,4R)-2-oxo-4-phenoxyazetidin-3-ylcarbamoyl)cyclohexyl)benzamide::4-[2-(4-Methyl-piperazin-1-yl)-thiazol-4-yl]-N-[1-((3S,4R)-2-oxo-4-phenoxy-azetidin-3-ylcarbamoyl)-cyclohexyl]-benzamide::CHEMBL367800
SMILES: CN1CCN(CC1)c1nc(cs1)-c1ccc(cc1)C(=O)NC1(CCCCC1)C(=O)N[C@H]1[C@H](NC1=O)Oc1ccccc1
InChI Key: InChIKey=UEDDBXBGISKEEX-LEAFIULHSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cathepsin K (Homo sapiens (Human)) | BDBM50318882 (4-(2-(4-methylpiperazin-1-yl)thiazol-4-yl)-N-(1-((...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen, Inc. Curated by ChEMBL | Assay Description Inhibition of cathepsin K | J Med Chem 53: 4332-53 (2010) Article DOI: 10.1021/jm9018756 BindingDB Entry DOI: 10.7270/Q21R6QPF | |||||||||||
More data for this Ligand-Target Pair |