Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Choline kinase alpha' and Ligand = 'BDBM50579767'   

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))	BDBM50579767 (CHEMBL5089440) Show SMILES Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc(cs1)C(F)(F)F |r,wU:11.12,14.19,(74.12,-4.48,;74.13,-6.02,;75.47,-6.78,;75.47,-8.33,;76.81,-9.1,;74.13,-9.11,;72.8,-8.33,;71.34,-8.81,;70.43,-7.56,;71.34,-6.32,;72.8,-6.8,;70.86,-10.27,;69.35,-10.58,;68.87,-12.04,;69.9,-13.19,;71.41,-12.87,;71.89,-11.41,;69.41,-14.65,;70.44,-15.8,;67.9,-14.96,;66.88,-13.81,;65.34,-13.96,;64.72,-12.55,;65.87,-11.53,;67.2,-12.3,;63.22,-12.22,;62.75,-10.75,;62.18,-13.36,;61.72,-11.81,)| 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	104	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