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 = 'BDBM500303'   

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))	BDBM500303 (US11021475, Example 114) Show SMILES CNC(=O)c1nnc(Nc2cc(C)nc(COC)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC Show InChI InChI=1S/C23H26N10O3/c1-13-9-17(29-19(26-13)11-35-4)28-18-10-16(20(31-30-18)23(34)24-2)27-15-8-6-7-14(21(15)36-5)22-25-12-33(3)32-22/h6-10,12H,11H2,1-5H3,(H,24,34)(H2,26,27,28,29,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.89	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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