Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK2' and Ligand = 'BDBM232621'   

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))	BDBM232621 (US9346815, 167 | US9604984, Example 167) Show SMILES Nc1nn2cccnc2c1C(=O)Nc1cn(nc1-c1cc(Cl)ccc1OC(F)F)C1CCN(CCCC(=O)NCc2ccccc2)CC1 Show InChI InChI=1S/C33H34ClF2N9O3/c34-22-9-10-26(48-33(35)36)24(18-22)29-25(40-32(47)28-30(37)42-44-15-5-13-38-31(28)44)20-45(41-29)23-11-16-43(17-12-23)14-4-8-27(46)39-19-21-6-2-1-3-7-21/h1-3,5-7,9-10,13,15,18,20,23,33H,4,8,11-12,14,16-17,19H2,(H2,37,42)(H,39,46)(H,40,47)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...				US Patent US9604984 (2017) BindingDB Entry DOI: 10.7270/Q26D5W25
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM232621 (US9346815, 167 | US9604984, Example 167) Show SMILES Nc1nn2cccnc2c1C(=O)Nc1cn(nc1-c1cc(Cl)ccc1OC(F)F)C1CCN(CCCC(=O)NCc2ccccc2)CC1 Show InChI InChI=1S/C33H34ClF2N9O3/c34-22-9-10-26(48-33(35)36)24(18-22)29-25(40-32(47)28-30(37)42-44-15-5-13-38-31(28)44)20-45(41-29)23-11-16-43(17-12-23)14-4-8-27(46)39-19-21-6-2-1-3-7-21/h1-3,5-7,9-10,13,15,18,20,23,33H,4,8,11-12,14,16-17,19H2,(H2,37,42)(H,39,46)(H,40,47)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.180	-55.1	n/a	n/a	n/a	n/a	n/a	7.2	22
Genentech, Inc. US Patent					Assay Description The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...				US Patent US9346815 (2016) BindingDB Entry DOI: 10.7270/Q2NS0SRT
					More data for this Ligand-Target Pair