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 = 'BDBM643588'   

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))	BDBM643588 (US20240002391, Compound 711) Show SMILES COc1nc(N[C@H]2C[C@](C)(O)C2)nn2ccc(-c3ccc(N=N)c(NCC(F)F)c3)c12 |r,wU:8.9,wD:6.5,8.8,(.31,.02,;-1.02,-.77,;-1.01,-2.31,;.35,-3.19,;.35,-4.73,;1.69,-5.5,;3.02,-4.73,;4.51,-5.13,;4.9,-3.64,;4.9,-2.1,;6.24,-2.87,;3.42,-3.25,;-.98,-5.5,;-2.32,-4.73,;-3.78,-5.21,;-4.69,-3.96,;-3.78,-2.72,;-4.26,-1.25,;-5.76,-.93,;-6.24,.53,;-5.21,1.68,;-5.68,3.14,;-4.65,4.29,;-3.7,1.36,;-2.93,2.69,;-1.4,2.85,;-.77,4.26,;-1.68,5.5,;.76,4.42,;-3.23,-.11,;-2.32,-3.19,)| 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	0.5	n/a	n/a	n/a	n/a
TBA									Citation and Details
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