null

SMILES: COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccc(O)c2)c1

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50579744   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Choline kinase alpha (Homo sapiens (Human))	BDBM50579744 (CHEMBL5092689) Show SMILES COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccc(O)c2)c1 |r,wU:13.16,10.9,(59.14,-11.11,;60.17,-12.25,;61.68,-11.93,;62.16,-10.46,;63.67,-10.15,;64.7,-11.3,;64.21,-12.76,;65.23,-13.91,;66.74,-13.6,;67.77,-14.75,;67.23,-12.13,;66.2,-10.98,;66.68,-9.52,;68.19,-9.21,;69.22,-10.35,;68.74,-11.82,;68.67,-7.75,;67.76,-6.5,;68.67,-5.26,;70.13,-5.73,;71.46,-4.96,;71.46,-3.42,;72.8,-5.72,;72.81,-7.27,;71.47,-8.05,;70.13,-7.27,;74.13,-8.04,;74.13,-9.58,;75.47,-10.35,;76.8,-9.58,;76.8,-8.03,;78.13,-7.25,;75.46,-7.27,;62.71,-13.08,)| 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	339	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