BDBM50438678 CHEMBL2414556

SMILES: CCn1cc(cn1)-c1cccc2nc(Nc3ccnc(C)c3)nn12

InChI Key: InChIKey=MDJXWFPNBCHSMW-UHFFFAOYSA-N

Data: 1 KI

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 = 50438678   

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))	BDBM50438678 (CHEMBL2414556) Show SMILES CCn1cc(cn1)-c1cccc2nc(Nc3ccnc(C)c3)nn12 Show InChI InChI=1S/C17H17N7/c1-3-23-11-13(10-19-23)15-5-4-6-16-21-17(22-24(15)16)20-14-7-8-18-12(2)9-14/h4-11H,3H2,1-2H3,(H,18,20,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of JAK2 (unknown origin)				Bioorg Med Chem Lett 23: 5014-21 (2013) Article DOI: 10.1016/j.bmcl.2013.06.008 BindingDB Entry DOI: 10.7270/Q29S1SF2
					More data for this Ligand-Target Pair