Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK2' and Ligand = 'BDBM232599'   

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))	BDBM232599 (US9346815, 145 | US9604984, Example 145) Show SMILES Nc1nn2cccnc2c1C(=O)Nc1cn(nc1-c1cc(Cl)ccc1OC(F)F)C1CCN(CCCNC(=O)c2ccccc2)CC1 Show InChI InChI=1S/C32H32ClF2N9O3/c33-21-8-9-25(47-32(34)35)23(18-21)27-24(39-31(46)26-28(36)41-43-15-5-12-37-29(26)43)19-44(40-27)22-10-16-42(17-11-22)14-4-13-38-30(45)20-6-2-1-3-7-20/h1-3,5-9,12,15,18-19,22,32H,4,10-11,13-14,16-17H2,(H2,36,41)(H,38,45)(H,39,46)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.160	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))	BDBM232599 (US9346815, 145 | US9604984, Example 145) Show SMILES Nc1nn2cccnc2c1C(=O)Nc1cn(nc1-c1cc(Cl)ccc1OC(F)F)C1CCN(CCCNC(=O)c2ccccc2)CC1 Show InChI InChI=1S/C32H32ClF2N9O3/c33-21-8-9-25(47-32(34)35)23(18-21)27-24(39-31(46)26-28(36)41-43-15-5-12-37-29(26)43)19-44(40-27)22-10-16-42(17-11-22)14-4-13-38-30(45)20-6-2-1-3-7-20/h1-3,5-9,12,15,18-19,22,32H,4,10-11,13-14,16-17H2,(H2,36,41)(H,38,45)(H,39,46)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.160	-55.3	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