Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK3' and Ligand = 'BDBM245784'   

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 JAK3 (Homo sapiens (Human))	BDBM245784 (US9428511, 68) Show SMILES CC[C@H]1CN(C[C@H]1Nc1c(cnn2cc(nc12)-c1cnn(C[C@H](C)O)c1)C(N)=O)C(=O)C1(CC1)C#N Show InChI InChI=1S/C24H29N9O3/c1-3-15-9-31(23(36)24(13-25)4-5-24)11-18(15)29-20-17(21(26)35)7-28-33-12-19(30-22(20)33)16-6-27-32(10-16)8-14(2)34/h6-7,10,12,14-15,18,29,34H,3-5,8-9,11H2,1-2H3,(H2,26,35)/t14-,15-,18+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.800	n/a	n/a	n/a	n/a	7.4	25
Bristol-Myers Squibb Company US Patent					Assay Description The assay reactions were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and su...				US Patent US9428511 (2016) BindingDB Entry DOI: 10.7270/Q27080B9
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