BDBM259468 US9512126, 5

SMILES: Cc1cc(ccc1C(=O)NC1CC1)-c1cnc2c(NCCC(F)(F)F)cc(nn12)C(F)c1cccc(F)c1

InChI Key: InChIKey=GWHGNRRUUCTBGS-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 = 259468   

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
GST-Dual specificity protein kinase TTK (Homo sapiens (Human))	BDBM259468 (US9512126, 5) Show SMILES Cc1cc(ccc1C(=O)NC1CC1)-c1cnc2c(NCCC(F)(F)F)cc(nn12)C(F)c1cccc(F)c1 |w:29.33| Show InChI InChI=1S/C27H24F5N5O/c1-15-11-16(5-8-20(15)26(38)35-19-6-7-19)23-14-34-25-22(33-10-9-27(30,31)32)13-21(36-37(23)25)24(29)17-3-2-4-18(28)12-17/h2-5,8,11-14,19,24,33H,6-7,9-10H2,1H3,(H,35,38)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.700	n/a	n/a	n/a	n/a	7.7	22
Bayer Intellectual Property GmbH US Patent					Assay Description The human kinase Mps-1 phosphorylates a biotinylated substrate peptide. Detection of the phosphorylated product is achieved by time-resolved fluoresc...				US Patent US9512126 (2016) BindingDB Entry DOI: 10.7270/Q2Q23Z5S
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