Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK1' and Ligand = 'BDBM50250935'   

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 JAK1 (Homo sapiens (Human))	BDBM50250935 (CHEMBL4085737) Show SMILES NC(=O)c1cn(nc1Nc1ccc(C#N)c(Cl)c1)[C@H]1COCC[C@@H]1C#N |r| Show InChI InChI=1S/C17H15ClN6O2/c18-14-5-12(2-1-10(14)6-19)22-17-13(16(21)25)8-24(23-17)15-9-26-4-3-11(15)7-20/h1-2,5,8,11,15H,3-4,9H2,(H2,21,25)(H,22,23)/t11-,15+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co., Inc. Curated by ChEMBL					Assay Description Inhibition of GST-tagged recombinant human JAK1 catalytic domain expressed in baculovirus expression system using LCB-EQEDEPEGDYFEWLW-NH2 as substrat...				J Med Chem 60: 9676-9690 (2017) Article DOI: 10.1021/acs.jmedchem.7b01135 BindingDB Entry DOI: 10.7270/Q20867RD
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50250935 (CHEMBL4085737) Show SMILES NC(=O)c1cn(nc1Nc1ccc(C#N)c(Cl)c1)[C@H]1COCC[C@@H]1C#N |r| Show InChI InChI=1S/C17H15ClN6O2/c18-14-5-12(2-1-10(14)6-19)22-17-13(16(21)25)8-24(23-17)15-9-26-4-3-11(15)7-20/h1-2,5,8,11,15H,3-4,9H2,(H2,21,25)(H,22,23)/t11-,15+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co., Inc. Curated by ChEMBL					Assay Description Inhibition of JAK1 in IL6-stimulated human ME180 cells expressing stably integrated beta-lactamase reporter gene under control of sis-inducible eleme...				J Med Chem 60: 9676-9690 (2017) Article DOI: 10.1021/acs.jmedchem.7b01135 BindingDB Entry DOI: 10.7270/Q20867RD
					More data for this Ligand-Target Pair