null

SMILES: CN(Cc1cc2cnc(nc2n1CCC1CCCCC1)C#N)c1ccccc1

InChI Key: InChIKey=AQIXEIGNFOLLPK-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50252653   

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))	BDBM50252653 (7-(2-cyclohexylethyl)-6-((methyl(phenyl)amino)meth...) Show SMILES CN(Cc1cc2cnc(nc2n1CCC1CCCCC1)C#N)c1ccccc1 Show InChI InChI=1S/C23H27N5/c1-27(20-10-6-3-7-11-20)17-21-14-19-16-25-22(15-24)26-23(19)28(21)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,14,16,18H,2,4-5,8-9,12-13,17H2,1H3	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	52	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of human recombinant cathepsin S by fluorescence assay				Bioorg Med Chem Lett 18: 3959-62 (2008) Article DOI: 10.1016/j.bmcl.2008.06.009 BindingDB Entry DOI: 10.7270/Q23N235B
					More data for this Ligand-Target Pair
Procathepsin L (Homo sapiens (Human))	BDBM50252653 (7-(2-cyclohexylethyl)-6-((methyl(phenyl)amino)meth...) Show SMILES CN(Cc1cc2cnc(nc2n1CCC1CCCCC1)C#N)c1ccccc1 Show InChI InChI=1S/C23H27N5/c1-27(20-10-6-3-7-11-20)17-21-14-19-16-25-22(15-24)26-23(19)28(21)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,14,16,18H,2,4-5,8-9,12-13,17H2,1H3	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	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of human recombinant cathepsin L by fluorescence assay				Bioorg Med Chem Lett 18: 3959-62 (2008) Article DOI: 10.1016/j.bmcl.2008.06.009 BindingDB Entry DOI: 10.7270/Q23N235B
					More data for this Ligand-Target Pair
Cathepsin K (Homo sapiens (Human))	BDBM50252653 (7-(2-cyclohexylethyl)-6-((methyl(phenyl)amino)meth...) Show SMILES CN(Cc1cc2cnc(nc2n1CCC1CCCCC1)C#N)c1ccccc1 Show InChI InChI=1S/C23H27N5/c1-27(20-10-6-3-7-11-20)17-21-14-19-16-25-22(15-24)26-23(19)28(21)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,14,16,18H,2,4-5,8-9,12-13,17H2,1H3	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	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibition of human recombinant cathepsin K by fluorescence assay				Bioorg Med Chem Lett 18: 3959-62 (2008) Article DOI: 10.1016/j.bmcl.2008.06.009 BindingDB Entry DOI: 10.7270/Q23N235B
					More data for this Ligand-Target Pair