BDBM213806 US9284317, 1-18

SMILES: C\C=C\c1cn2c(cnc2c(NCc2ccnn2C)n1)-c1ccc(C(=O)NC2CC2)c(F)c1

InChI Key: InChIKey=UGMYYWDEQWSMPN-ONEGZZNKSA-N

Data: 1 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 1 hit for monomerid = 213806   

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
Dual specificity protein kinase TTK (Homo sapiens (Human))	BDBM213806 (US9284317, 1-18) Show SMILES C\C=C\c1cn2c(cnc2c(NCc2ccnn2C)n1)-c1ccc(C(=O)NC2CC2)c(F)c1 Show InChI InChI=1S/C24H24FN7O/c1-3-4-17-14-32-21(15-5-8-19(20(25)11-15)24(33)30-16-6-7-16)13-27-23(32)22(29-17)26-12-18-9-10-28-31(18)2/h3-5,8-11,13-14,16H,6-7,12H2,1-2H3,(H,26,29)(H,30,33)/b4-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	31.9	n/a	n/a	n/a	n/a	7.7	22
Bayer Intellectual Property GmbH US Patent					Assay Description For the assay 50 nL of a 100-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...				US Patent US9284317 (2016) BindingDB Entry DOI: 10.7270/Q2HM5799
					More data for this Ligand-Target Pair