Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Non-receptor tyrosine-protein kinase TYK2 [575-869]' and Ligand = 'BDBM500318'   

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 [575-869] (Homo sapiens (Human))	BDBM500318 (US11021475, Example 188) Show SMILES CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnn(CC(F)F)c2)c1OC Show InChI InChI=1S/C22H23F2N7O3/c1-25-22(33)19-16(8-18(29-30-19)28-21(32)12-6-7-12)27-15-5-3-4-14(20(15)34-2)13-9-26-31(10-13)11-17(23)24/h3-5,8-10,12,17H,6-7,11H2,1-2H3,(H,25,33)(H2,27,28,29,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	5.10	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The probe displacement assay is conducted as follows: In a 385 well plate, test compounds along with recombinantly expressed His-tagged protein corre...				US Patent US11021475 (2021) BindingDB Entry DOI: 10.7270/Q2S75KGC
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