Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Non-receptor tyrosine-protein kinase TYK2/Tyrosine-protein kinase JAK1' and Ligand = 'BDBM50261794'   

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
Non-receptor tyrosine-protein kinase TYK2/Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50261794 (CHEMBL4065693) Show SMILES NC(=O)c1cnc(Nc2ccccc2)cc1NCc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C22H21N5O2/c1-2-21(28)27-17-10-6-7-15(11-17)13-24-19-12-20(25-14-18(19)22(23)29)26-16-8-4-3-5-9-16/h2-12,14H,1,13H2,(H2,23,29)(H,27,28)(H2,24,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development, Princeton, NJ 08543-4000, USA. Electronic address: james.kempson@bms.com. Curated by ChEMBL					Assay Description Inhibition of JAK1/TYK2 in human PBMC derived T cell assessed as reduction in IFNa2a-induced STAT3 phosphorylation after 30 mins by ELISA				Bioorg Med Chem Lett 27: 4622-4625 (2017) Article DOI: 10.1016/j.bmcl.2017.09.023 BindingDB Entry DOI: 10.7270/Q2X069HQ
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