null
SMILES: CN1C(N)=N[C@@]2(C1=O)c1cc(ccc1O[C@H]1CCOC[C@]21C)-c1cccnc1F
InChI Key: InChIKey=IEKFRFUMPZXQKY-ORYQWCPZSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cathepsin D (Homo sapiens (Human)) | BDBM50448553 (CHEMBL3127080) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 490 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma Curated by ChEMBL | Assay Description Inhibition of human liver cathepsin D measured for 1 hr by FRET assay | J Med Chem 57: 878-902 (2014) Article DOI: 10.1021/jm401635n BindingDB Entry DOI: 10.7270/Q2QJ7JS7 | |||||||||||
More data for this Ligand-Target Pair |