BDBM50438672 CHEMBL2414536

SMILES: COc1ccc(cc1)-c1cccn2nc(Nc3cnn(c3)[C@H](C)CO)nc12

InChI Key: InChIKey=SOAZJXRYDAOFEW-CYBMUJFWSA-N

Data: 1 KI  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 2 hits for monomerid = 50438672   

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))	BDBM50438672 (CHEMBL2414536) Show SMILES COc1ccc(cc1)-c1cccn2nc(Nc3cnn(c3)[C@H](C)CO)nc12 |r| Show InChI InChI=1S/C19H20N6O2/c1-13(12-26)25-11-15(10-20-25)21-19-22-18-17(4-3-9-24(18)23-19)14-5-7-16(27-2)8-6-14/h3-11,13,26H,12H2,1-2H3,(H,21,23)/t13-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40	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
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50438672 (CHEMBL2414536) Show SMILES COc1ccc(cc1)-c1cccn2nc(Nc3cnn(c3)[C@H](C)CO)nc12 |r| Show InChI InChI=1S/C19H20N6O2/c1-13(12-26)25-11-15(10-20-25)21-19-22-18-17(4-3-9-24(18)23-19)14-5-7-16(27-2)8-6-14/h3-11,13,26H,12H2,1-2H3,(H,21,23)/t13-/m1/s1	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	89	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of JAK2 in human SET2 cells assessed as reduction of phosphorylated STAT5 level				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