BDBM50189985 4-[1-(3,4,5-trimethoxybenzoyl)naphthalen-2-yloxy]-but-2-enoic acid-3,4,5-trimethoxyphenylamide::CHEMBL213744
SMILES: COc1cc(NC(=O)\C=C\COc2ccc3ccccc3c2C(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
InChI Key: InChIKey=DHXYWPMNLSEIMY-FMIVXFBMSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cathepsin D (Homo sapiens (Human)) | BDBM50189985 (4-[1-(3,4,5-trimethoxybenzoyl)naphthalen-2-yloxy]-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Medicinal and Aromatic Plants Curated by ChEMBL | Assay Description Inhibition of human cathepsin D | Bioorg Med Chem Lett 16: 4603-8 (2006) Article DOI: 10.1016/j.bmcl.2006.06.010 BindingDB Entry DOI: 10.7270/Q2FB53QN | |||||||||||
More data for this Ligand-Target Pair |