null

SMILES: NC(=O)c1c2CN(C[C@@H](CF)n2nc1-c1cccc(Cl)c1)C(=O)Nc1ccc([N+]#[C-])c(F)c1

InChI Key: InChIKey=HJCGAHKLOIFPMI-OAHLLOKOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 302780   

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))	BDBM302780 ((S)-2-(3- Chlorophenyl)-N5- (4-cyano-3-fluoropheny...) Show SMILES NC(=O)c1c2CN(C[C@@H](CF)n2nc1-c1cccc(Cl)c1)C(=O)Nc1ccc([N+]#[C-])c(F)c1 |r,$;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$| Show InChI InChI=1S/C22H17ClF2N6O2/c1-27-17-6-5-14(8-16(17)25)28-22(33)30-10-15(9-24)31-18(11-30)19(21(26)32)20(29-31)12-3-2-4-13(23)7-12/h2-8,15H,9-11H2,(H2,26,32)(H,28,33)/t15-/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))	BDBM302780 ((S)-2-(3- Chlorophenyl)-N5- (4-cyano-3-fluoropheny...) Show SMILES NC(=O)c1c2CN(C[C@@H](CF)n2nc1-c1cccc(Cl)c1)C(=O)Nc1ccc([N+]#[C-])c(F)c1 |r,$;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$| Show InChI InChI=1S/C22H17ClF2N6O2/c1-27-17-6-5-14(8-16(17)25)28-22(33)30-10-15(9-24)31-18(11-30)19(21(26)32)20(29-31)12-3-2-4-13(23)7-12/h2-8,15H,9-11H2,(H2,26,32)(H,28,33)/t15-/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