BDBM50337718 CHEMBL1683438::N-(cyanomethyl)-3-(5-(4-((tetrahydro-2H-pyran-4-ylamino)methyl)phenyl)isoxazol-3-yl)benzamide

SMILES: O=C(NCC#N)c1cccc(c1)-c1cc(on1)-c1ccc(CNC2CCOCC2)cc1

InChI Key: InChIKey=KLLMAOKFQYIYBE-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 = 50337718   

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
Serine/threonine-protein kinase D1 (Homo sapiens (Human))	BDBM50337718 (CHEMBL1683438 | N-(cyanomethyl)-3-(5-(4-((tetrahyd...) Show SMILES O=C(NCC#N)c1cccc(c1)-c1cc(on1)-c1ccc(CNC2CCOCC2)cc1 Show InChI InChI=1S/C24H24N4O3/c25-10-11-26-24(29)20-3-1-2-19(14-20)22-15-23(31-28-22)18-6-4-17(5-7-18)16-27-21-8-12-30-13-9-21/h1-7,14-15,21,27H,8-9,11-13,16H2,(H,26,29)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	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 PKD1 by TR-FRET assay				Bioorg Med Chem Lett 21: 1447-51 (2011) Article DOI: 10.1016/j.bmcl.2011.01.014 BindingDB Entry DOI: 10.7270/Q2JM29WX
					More data for this Ligand-Target Pair