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 = 'BDBM643652'   

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))	BDBM643652 (US20240002391, Compound 934) Show SMILES COc1nc(N[C@H]2C[C@](C)(C2)NC(C)=O)nn2ccc(-c3cnc4nccn4c3)c12 |r,wU:8.8,wD:6.5,8.11,(-1.12,.74,;-2.45,-.03,;-2.45,-1.57,;-1.12,-2.34,;-1.12,-3.88,;.21,-4.65,;1.55,-3.88,;3.04,-4.28,;3.43,-2.79,;3.43,-1.25,;1.95,-2.39,;4.77,-2.02,;6.1,-2.79,;7.43,-2.02,;6.1,-4.33,;-2.45,-4.65,;-3.79,-3.88,;-5.25,-4.36,;-6.16,-3.11,;-5.25,-1.87,;-5.65,-.38,;-7.11,.1,;-7.43,1.6,;-6.29,2.64,;-6.29,4.18,;-4.83,4.65,;-3.92,3.41,;-4.83,2.16,;-4.51,.65,;-3.79,-2.34,)| 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	1.60	n/a	n/a	n/a	n/a
TBA									Citation and Details
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