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SMILES: CC[C@@H]1CN(Cc2c(C(N)=O)c(nn12)-c1ccc(F)c(Cl)c1)C(=O)Nc1ccc(cc1)C#N

InChI Key: InChIKey=GPRFKTHLBHCZLB-MRXNPFEDSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 302839   

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 I isoform delta (Homo sapiens (Human))	BDBM302839 (2-(3-Chloro-4-fluorophenyl)-N5-(4-cyanophenyl)-7-e...) Show SMILES CC[C@@H]1CN(Cc2c(C(N)=O)c(nn12)-c1ccc(F)c(Cl)c1)C(=O)Nc1ccc(cc1)C#N |r| Show InChI InChI=1S/C23H20ClFN6O2/c1-2-16-11-30(23(33)28-15-6-3-13(10-26)4-7-15)12-19-20(22(27)32)21(29-31(16)19)14-5-8-18(25)17(24)9-14/h3-9,16H,2,11-12H2,1H3,(H2,27,32)(H,28,33)/t16-/m1/s1	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
					More data for this Ligand-Target Pair
Casein kinase I isoform epsilon (Homo sapiens (Human))	BDBM302839 (2-(3-Chloro-4-fluorophenyl)-N5-(4-cyanophenyl)-7-e...) Show SMILES CC[C@@H]1CN(Cc2c(C(N)=O)c(nn12)-c1ccc(F)c(Cl)c1)C(=O)Nc1ccc(cc1)C#N |r| Show InChI InChI=1S/C23H20ClFN6O2/c1-2-16-11-30(23(33)28-15-6-3-13(10-26)4-7-15)12-19-20(22(27)32)21(29-31(16)19)14-5-8-18(25)17(24)9-14/h3-9,16H,2,11-12H2,1H3,(H2,27,32)(H,28,33)/t16-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
					More data for this Ligand-Target Pair