BDBM255204 US9475817, 163

SMILES: Cn1nc(c(c1C1CCN(CC(N)=O)CC1)-c1ccc2nc(NC(=O)c3ccnc(c3)N3CCOCC3)cn2n1)-c1ccc(F)cc1

InChI Key: InChIKey=AQSSKWJXFIRYFL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 255204   

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))	BDBM255204 (US9475817, 163) Show SMILES Cn1nc(c(c1C1CCN(CC(N)=O)CC1)-c1ccc2nc(NC(=O)c3ccnc(c3)N3CCOCC3)cn2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN10O3/c1-41-32(22-9-12-42(13-10-22)19-26(35)45)30(31(40-41)21-2-4-24(34)5-3-21)25-6-7-28-37-27(20-44(28)39-25)38-33(46)23-8-11-36-29(18-23)43-14-16-47-17-15-43/h2-8,11,18,20,22H,9-10,12-17,19H2,1H3,(H2,35,45)(H,38,46)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.400	n/a	n/a	n/a	n/a	7.4	25
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 ul prepared from 15 ul additions of enzyme, substrates (flu...				US Patent US9475817 (2016) BindingDB Entry DOI: 10.7270/Q2JQ0ZXH
					More data for this Ligand-Target Pair
Casein kinase I isoform epsilon (Homo sapiens (Human))	BDBM255204 (US9475817, 163) Show SMILES Cn1nc(c(c1C1CCN(CC(N)=O)CC1)-c1ccc2nc(NC(=O)c3ccnc(c3)N3CCOCC3)cn2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN10O3/c1-41-32(22-9-12-42(13-10-22)19-26(35)45)30(31(40-41)21-2-4-24(34)5-3-21)25-6-7-28-37-27(20-44(28)39-25)38-33(46)23-8-11-36-29(18-23)43-14-16-47-17-15-43/h2-8,11,18,20,22H,9-10,12-17,19H2,1H3,(H2,35,45)(H,38,46)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	7.4	25
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 ul prepared from 15 ul additions of enzyme, substrates (flu...				US Patent US9475817 (2016) BindingDB Entry DOI: 10.7270/Q2JQ0ZXH
					More data for this Ligand-Target Pair