BDBM11320 3-{[4-(2-{[3-(1,1,2,2-tetrafluoroethoxy)phenyl]amino}pyrimidin-4-yl)pyridin-2-yl]amino}propan-1-ol::CGP06028

SMILES: OCCCNc1cc(ccn1)-c1ccnc(Nc2cccc(OC(F)(F)C(F)F)c2)n1

InChI Key: InChIKey=LZJBQFGZJIYHES-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 11320   

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
Casein kinase II subunit alpha (Homo sapiens (Human))	BDBM11320 (3-{[4-(2-{[3-(1,1,2,2-tetrafluoroethoxy)phenyl]ami...) Show SMILES OCCCNc1cc(ccn1)-c1ccnc(Nc2cccc(OC(F)(F)C(F)F)c2)n1 Show InChI InChI=1S/C20H19F4N5O2/c21-18(22)20(23,24)31-15-4-1-3-14(12-15)28-19-27-9-6-16(29-19)13-5-8-26-17(11-13)25-7-2-10-30/h1,3-6,8-9,11-12,18,30H,2,7,10H2,(H,25,26)(H,27,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	7.5	22
University of Padova					Assay Description In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of 100 uM ATP/ [gam...				Biochem J 374: 639-46 (2003) Article DOI: 10.1042/BJ20030674 BindingDB Entry DOI: 10.7270/Q2BV7DTQ
					More data for this Ligand-Target Pair