Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK1' and Ligand = 'BDBM549197'   

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))	BDBM549197 (US11299492, Example 3-30 | US11718616, Example 3-3...) Show SMILES CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CC(C1)OC |(-9.49,-2.64,;-8.14,-1.85,;-8.11,-.27,;-9.44,.46,;-9.44,2.04,;-10.82,2.74,;-8.14,2.77,;-8.11,4.29,;-6.8,2.01,;-6.8,.49,;-5.45,-.3,;-4.14,.43,;-2.78,-.3,;-2.81,-1.82,;-1.61,-2.85,;-2.27,-4.29,;-3.81,-4.13,;-4.09,-2.58,;-5.45,-1.82,;-.09,-2.55,;.81,-1.31,;2.28,-1.78,;3.61,-1.01,;4.94,-1.78,;4.94,-3.32,;3.61,-4.09,;2.28,-3.32,;.81,-3.8,;6.28,-1.01,;7.77,-1.41,;8.16,.07,;6.68,.47,;9.5,.84,;9.5,2.42,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		<0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q29027WQ
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM549197 (US11299492, Example 3-30 | US11718616, Example 3-3...) Show SMILES CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CC(C1)OC |(-9.49,-2.64,;-8.14,-1.85,;-8.11,-.27,;-9.44,.46,;-9.44,2.04,;-10.82,2.74,;-8.14,2.77,;-8.11,4.29,;-6.8,2.01,;-6.8,.49,;-5.45,-.3,;-4.14,.43,;-2.78,-.3,;-2.81,-1.82,;-1.61,-2.85,;-2.27,-4.29,;-3.81,-4.13,;-4.09,-2.58,;-5.45,-1.82,;-.09,-2.55,;.81,-1.31,;2.28,-1.78,;3.61,-1.01,;4.94,-1.78,;4.94,-3.32,;3.61,-4.09,;2.28,-3.32,;.81,-3.8,;6.28,-1.01,;7.77,-1.41,;8.16,.07,;6.68,.47,;9.5,.84,;9.5,2.42,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description All of the compounds of Examples 1 to 16 and Tables 1 to 19 were tested in one or more of the assays described above. In the following tables, for th...				Citation and Details BindingDB Entry DOI: 10.7270/Q2T156V0
					More data for this Ligand-Target Pair