Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 402.8 BDBM207009

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
Casein kinase I isoform epsilon (Homo sapiens (Human))	BDBM207009 (US9233965, 93) Show SMILES NC(=O)c1c2CN(CCn2c(Cl)c1-c1ccccc1)C(=O)NC1CCOCC1 Show InChI InChI=1S/C20H23ClN4O3/c21-18-16(13-4-2-1-3-5-13)17(19(22)26)15-12-24(8-9-25(15)18)20(27)23-14-6-10-28-11-7-14/h1-5,14H,6-12H2,(H2,22,26)(H,23,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	7.5	25
SANOFI US Patent					Assay Description "U"-bottomed Falcon plates are prepared by placing 5 uL of solutions of the compounds according to the invention at concentrations of 10, 1, 0.1, 0.0...				US Patent US9233965 (2016) BindingDB Entry DOI: 10.7270/Q2086443
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