BDBM50249413 5-amino-4-(bicyclo[2.2.1]heptan-2-ylamino)-6-morpholinopyrimidine-2-carbonitrile::CHEMBL470915

SMILES: Nc1c(NC2CC3CCC2C3)nc(nc1N1CCOCC1)C#N

InChI Key: InChIKey=CAEDNKKZJRIJKC-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 = 50249413   

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 K (Homo sapiens (Human))	BDBM50249413 (5-amino-4-(bicyclo[2.2.1]heptan-2-ylamino)-6-morph...) Show SMILES Nc1c(NC2CC3CCC2C3)nc(nc1N1CCOCC1)C#N |THB:3:4:10:8.7| Show InChI InChI=1S/C16H22N6O/c17-9-13-20-15(19-12-8-10-1-2-11(12)7-10)14(18)16(21-13)22-3-5-23-6-4-22/h10-12H,1-8,18H2,(H,19,20,21)	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	2	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of cathepsin K (unknown origin)				Bioorg Med Chem Lett 19: 1658-61 (2009) Article DOI: 10.1016/j.bmcl.2009.01.110 BindingDB Entry DOI: 10.7270/Q2571BWR
					More data for this Ligand-Target Pair