BDBM50152984 1-(4-Phenyl-piperazin-1-yl)-3-(3-phenyl-4,5,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-1-yl)-propan-2-ol::CHEMBL363669

SMILES: OC(CN1CCN(CC1)c1ccccc1)Cn1nc(c2CNCCc12)-c1ccccc1

InChI Key: InChIKey=QOTIJIIDTGKSQF-UHFFFAOYSA-N

Data: 1 IC50

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 = 50152984   

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 S (Homo sapiens (Human))	BDBM50152984 (1-(4-Phenyl-piperazin-1-yl)-3-(3-phenyl-4,5,6,7-te...) Show SMILES OC(CN1CCN(CC1)c1ccccc1)Cn1nc(c2CNCCc12)-c1ccccc1 Show InChI InChI=1S/C25H31N5O/c31-22(18-28-13-15-29(16-14-28)21-9-5-2-6-10-21)19-30-24-11-12-26-17-23(24)25(27-30)20-7-3-1-4-8-20/h1-10,22,26,31H,11-19H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development L.L.C. Curated by ChEMBL					Assay Description Inhibitory concentration against human cysteine protease cathepsin S				J Med Chem 47: 4799-801 (2004) Article DOI: 10.1021/jm0496133 BindingDB Entry DOI: 10.7270/Q28P6008
					More data for this Ligand-Target Pair