Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dual specificity tyrosine-phosphorylation-regulated kinase 1A' and Ligand = 'BDBM643296'   

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
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM643296 (US20240002391, Compound 8) Show SMILES COc1nc(N[C@H]2C[C@](C)(O)C2)nn2ccc(-c3ccn4nccc4c3)c12 |r,wU:8.9,wD:6.5,8.8,(-2.29,.7,;-.95,-.07,;-.95,-1.61,;.38,-2.38,;.38,-3.92,;1.7,-4.69,;3.03,-3.92,;4.52,-4.32,;4.92,-2.83,;4.92,-1.29,;6.25,-2.06,;3.43,-2.43,;-.95,-4.69,;-2.29,-3.92,;-3.72,-4.41,;-4.62,-3.19,;-3.75,-1.86,;-4.24,-.4,;-5.74,-.07,;-6.25,1.42,;-5.22,2.59,;-5.34,4.13,;-3.91,4.72,;-2.91,3.54,;-3.72,2.22,;-3.21,.8,;-2.29,-2.38,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	0.600	n/a	n/a	n/a	n/a
TBA									Citation and Details
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