BDBM211962 US9290482, 2

SMILES: COc1nccc2oc(cc12)-c1cnc2ccc(OCC3CNC3)nn12

InChI Key: InChIKey=OEQQISQELMRZDV-UHFFFAOYSA-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 = 211962   

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
MAP kinase-interacting serine/threonine-protein kinase 1 (T344D) (Homo sapiens (Human))	BDBM211962 (US9290482, 2) Show SMILES COc1nccc2oc(cc12)-c1cnc2ccc(OCC3CNC3)nn12 Show InChI InChI=1S/C18H17N5O3/c1-24-18-12-6-15(26-14(12)4-5-20-18)13-9-21-16-2-3-17(22-23(13)16)25-10-11-7-19-8-11/h2-6,9,11,19H,7-8,10H2,1H3	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	31	n/a	n/a	n/a	n/a	7.5	22
BAYER PHARMA AKTIENGESELLSCHAFT US Patent					Assay Description For the assay 50 nl nL of a 100fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384well microtiter plate ...				US Patent US9290482 (2016) BindingDB Entry DOI: 10.7270/Q2B856ZD
					More data for this Ligand-Target Pair