BDBM50166939 CHEMBL3800434

SMILES: Cn1c(cc2c(ncnc12)-c1ccc(NC(=O)c2ccc(cc2)C#N)cc1)C(N)=O

InChI Key: InChIKey=GCEAGASDJBHCCA-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 = 50166939   

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))	BDBM50166939 (CHEMBL3800434) Show SMILES Cn1c(cc2c(ncnc12)-c1ccc(NC(=O)c2ccc(cc2)C#N)cc1)C(N)=O Show InChI InChI=1S/C22H16N6O2/c1-28-18(20(24)29)10-17-19(25-12-26-21(17)28)14-6-8-16(9-7-14)27-22(30)15-4-2-13(11-23)3-5-15/h2-10,12H,1H3,(H2,24,29)(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant human GST-tagged JAK2 expressed in baculovirus expression system using Z'-LYTE Try6 peptide as substrate incubated for 1 hr...				Bioorg Med Chem Lett 26: 2936-2941 (2016) Article DOI: 10.1016/j.bmcl.2016.04.027 BindingDB Entry DOI: 10.7270/Q2GB25ZS
					More data for this Ligand-Target Pair