Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK2' and Ligand = 'BDBM322964'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM322964 (2-(azepan-1-yl)-4-((4-(methylsulfonyl) phenyl)amin...) Show SMILES CS(=O)(=O)c1ccc(Nc2nc(nc3cn[nH]c(=O)c23)N2CCCCCC2)cc1 Show InChI InChI=1S/C19H22N6O3S/c1-29(27,28)14-8-6-13(7-9-14)21-17-16-15(12-20-24-18(16)26)22-19(23-17)25-10-4-2-3-5-11-25/h6-9,12H,2-5,10-11H2,1H3,(H,24,26)(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
Asan BioSciences, LLC US Patent					Assay Description Two μL of 10% DMSO in blank, substrate control and positive control wells and 2 μL of test compound in test wells was added. Thirteen μ...				US Patent US10647720 (2020) BindingDB Entry DOI: 10.7270/Q2QJ7MB7
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM322964 (2-(azepan-1-yl)-4-((4-(methylsulfonyl) phenyl)amin...) Show SMILES CS(=O)(=O)c1ccc(Nc2nc(nc3cn[nH]c(=O)c23)N2CCCCCC2)cc1 Show InChI InChI=1S/C19H22N6O3S/c1-29(27,28)14-8-6-13(7-9-14)21-17-16-15(12-20-24-18(16)26)22-19(23-17)25-10-4-2-3-5-11-25/h6-9,12H,2-5,10-11H2,1H3,(H,24,26)(H,21,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
Asana BioSciences, LLC US Patent					Assay Description Two μL of 10% DMSO in blank, substrate control and positive control wells and 2 μL of test compound in test wells was added. Thirteen μ...				US Patent US10183944 (2019) BindingDB Entry DOI: 10.7270/Q2BC41MH
					More data for this Ligand-Target Pair