Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 462.3 BDBM50001141

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
DNA polymerase alpha catalytic subunit (Homo sapiens (Human))	BDBM50001141 (CHEMBL3236417) Show SMILES Nc1ccn([C@@H]2O[C@H](COP(S)(=O)NC(=O)c3ccccc3)[C@@H](O)C2(F)F)c(=O)n1 |r| Show InChI InChI=1S/C16H17F2N4O6PS/c17-16(18)12(23)10(28-14(16)22-7-6-11(19)20-15(22)25)8-27-29(26,30)21-13(24)9-4-2-1-3-5-9/h1-7,10,12,14,23H,8H2,(H2,19,20,25)(H2,21,24,26,30)/t10-,12-,14-,29?/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.50E+5	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human DNA polymerase alpha using dCTP as substrate assessed as single base extension reaction after 2 hrs				Bioorg Med Chem 22: 2133-40 (2014) Article DOI: 10.1016/j.bmc.2014.02.034 BindingDB Entry DOI: 10.7270/Q20866TW
					More data for this Ligand-Target Pair