Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 403.5 BDBM50337700

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50337700 (3-(5-(4-(4-methylpiperazin-1-yl)phenyl)-1H-pyrazol...) Show SMILES CCCNC(=O)c1cccc(c1)-c1cc([nH]n1)-c1ccc(cc1)N1CCN(C)CC1 Show InChI InChI=1S/C24H29N5O/c1-3-11-25-24(30)20-6-4-5-19(16-20)23-17-22(26-27-23)18-7-9-21(10-8-18)29-14-12-28(2)13-15-29/h4-10,16-17H,3,11-15H2,1-2H3,(H,25,30)(H,26,27)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+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 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
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