BDBM130347 US8815840, 563

SMILES: NC(=O)c1cc(cc2c3ccc(cc3[nH]c12)C(=O)N1CCOCC1)-c1ccc(F)c(c1)C#N

InChI Key: InChIKey=LBFAUFCJKQSJNK-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 = 130347   

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
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM130347 (US8815840, 563) Show SMILES NC(=O)c1cc(cc2c3ccc(cc3[nH]c12)C(=O)N1CCOCC1)-c1ccc(F)c(c1)C#N Show InChI InChI=1S/C25H19FN4O3/c26-21-4-2-14(9-17(21)13-27)16-10-19-18-3-1-15(25(32)30-5-7-33-8-6-30)12-22(18)29-23(19)20(11-16)24(28)31/h1-4,9-12,29H,5-8H2,(H2,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a	7.4	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in V-bottom 384-well plates. The final assay volume was 30 ul prepared from 15 ul additions of enzyme and substrates (fluor...				US Patent US8815840 (2014) BindingDB Entry DOI: 10.7270/Q28P5Z65
					More data for this Ligand-Target Pair