Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK1' and Ligand = 'BDBM50392013'   

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))	BDBM50392013 (CHEMBL2152404) Show SMILES CN1CCC[C@H]1C(=O)N1CCC(CC1)n1cnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C19H24N6O/c1-23-8-2-3-16(23)19(26)24-9-5-13(6-10-24)25-12-22-15-11-21-18-14(17(15)25)4-7-20-18/h4,7,11-13,16H,2-3,5-6,8-10H2,1H3,(H,20,21)/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Argenta Discovery Ltd. Curated by ChEMBL					Assay Description Inhibition of JAK1				J Med Chem 55: 5901-21 (2012) Article DOI: 10.1021/jm300438j BindingDB Entry DOI: 10.7270/Q2DV1KZX
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50392013 (CHEMBL2152404) Show SMILES CN1CCC[C@H]1C(=O)N1CCC(CC1)n1cnc2cnc3[nH]ccc3c12 |r| Show InChI InChI=1S/C19H24N6O/c1-23-8-2-3-16(23)19(26)24-9-5-13(6-10-24)25-12-22-15-11-21-18-14(17(15)25)4-7-20-18/h4,7,11-13,16H,2-3,5-6,8-10H2,1H3,(H,20,21)/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>8.60E+3	n/a	n/a	n/a	n/a
Argenta Discovery Ltd. Curated by ChEMBL					Assay Description Inhibition of JAK1 in human TF1 cells assessed as inhibition of IL2-induced STAT3 phosphorylation				J Med Chem 55: 5901-21 (2012) Article DOI: 10.1021/jm300438j BindingDB Entry DOI: 10.7270/Q2DV1KZX
					More data for this Ligand-Target Pair