Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 259.3 BDBM50042444

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))	BDBM50042444 (6-Methoxy-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahy...) Show SMILES COc1ccc2CC[C@H]3C(C)(N)CCC[C@]3(C)c2c1 Show InChI InChI=1S/C17H25NO/c1-16-9-4-10-17(2,18)15(16)8-6-12-5-7-13(19-3)11-14(12)16/h5,7,11,15H,4,6,8-10,18H2,1-3H3/t15-,16-,17?/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
Wellcome Research Laboratories Curated by ChEMBL					Assay Description Effective concentration against DNA polymerase alpha				J Med Chem 36: 3503-10 (1994) BindingDB Entry DOI: 10.7270/Q2HT2PXP
					More data for this Ligand-Target Pair