BDBM50237045 CHEMBL4073007

SMILES: Fc1cnc(nc1N(Cc1ccc2OCOc2c1)C1CCCCC1)C#N

InChI Key: InChIKey=QTVPDZJZFZDWSN-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50237045   

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
Procathepsin L (Homo sapiens (Human))	BDBM50237045 (CHEMBL4073007) Show SMILES Fc1cnc(nc1N(Cc1ccc2OCOc2c1)C1CCCCC1)C#N Show InChI InChI=1S/C19H19FN4O2/c20-15-10-22-18(9-21)23-19(15)24(14-4-2-1-3-5-14)11-13-6-7-16-17(8-13)26-12-25-16/h6-8,10,14H,1-5,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Roche Pharmaceutical Research and Early Development (pRED) Curated by ChEMBL					Assay Description Inhibition of human Cathepsin L				J Med Chem 60: 2485-2497 (2017) Article DOI: 10.1021/acs.jmedchem.6b01881 BindingDB Entry DOI: 10.7270/Q2PV6NN3
					More data for this Ligand-Target Pair