Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK1 [574-1154]' and Ligand = 'BDBM493131'   

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 [574-1154] (Homo sapiens (Human))	BDBM493131 (2-(1-((1r,4r)-4-(Cyanomethyl)cyclohexyl)-1,6-dihyd...) Show SMILES COC(C)(C)CNC(=O)Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:25.28,wD:22.24,(-8.17,2.3,;-7.4,3.63,;-5.86,3.63,;-6.26,5.12,;-4.53,4.4,;-5.09,2.3,;-3.55,2.3,;-2.78,.96,;-3.55,-.37,;-1.24,.96,;-.47,-.37,;-1.1,-1.78,;.04,-2.81,;.04,-4.35,;1.38,-5.12,;2.71,-4.35,;4.18,-4.82,;5.08,-3.58,;4.18,-2.33,;2.71,-2.81,;1.38,-2.04,;1.06,-.53,;2.09,.61,;3.59,.29,;4.63,1.44,;4.15,2.9,;5.18,4.05,;6.69,3.73,;8.17,3.41,;2.64,3.22,;1.61,2.08,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description 11-point dosing series were made for each compound by serially diluting 1:3 or 1:4 in DMSO, with point 12 being a DMSO control. From the serial dilut...				US Patent US10981911 (2021) BindingDB Entry DOI: 10.7270/Q27P92G6
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