Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Casein kinase I isoform delta' and Ligand = 'BDBM302819'   

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 delta (Homo sapiens (Human))	BDBM302819 (2-(3-Chloro-4-fluorophenyl)- N5-(4-cyano-3- morpho...) Show SMILES NC(=O)c1c2CN(CCn2nc1-c1ccc(F)c(Cl)c1)C(=O)Nc1ccc(C#N)c(c1)N1CCOCC1 |$;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;$| Show InChI InChI=1S/C25H23ClFN7O3/c26-18-11-15(2-4-19(18)27)23-22(24(29)35)21-14-33(5-6-34(21)31-23)25(36)30-17-3-1-16(13-28)20(12-17)32-7-9-37-10-8-32/h1-4,11-12H,5-10,14H2,(H2,29,35)(H,30,36)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The kinase assay was performed in V-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme, subst...				US Patent US9598423 (2017) BindingDB Entry DOI: 10.7270/Q2FJ2JT9
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