Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Choline kinase alpha' and Ligand = 'BDBM50579737'   

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
Choline kinase alpha (Homo sapiens (Human))	BDBM50579737 (CHEMBL5071615) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1 |r,wU:10.11,13.18,(29.63,-34.62,;29.63,-36.16,;30.97,-36.92,;30.97,-38.48,;29.64,-39.25,;28.3,-38.48,;26.83,-38.95,;25.93,-37.7,;26.84,-36.46,;28.3,-36.94,;26.36,-40.41,;24.85,-40.72,;24.37,-42.18,;25.39,-43.33,;26.9,-43.02,;27.39,-41.55,;24.91,-44.8,;25.94,-45.95,;23.4,-45.11,;22.38,-43.96,;22.86,-42.5,;21.84,-41.35,;20.33,-41.66,;19.85,-43.14,;20.87,-44.28,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	354	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of ChoKalpha (unknown origin) by HTS assay				Citation and Details Article DOI: 10.1016/j.bmcl.2021.128310 BindingDB Entry DOI: 10.7270/Q27H1PFF
					More data for this Ligand-Target Pair