BDBM50080284 6-(1-Hydroxy-propyl)-5,8-dimethoxy-[1,4]naphthoquinone::CHEMBL79103

SMILES: CCC(O)c1cc(OC)c2C(=O)C=CC(=O)c2c1OC

InChI Key: InChIKey=GAGVIHYUBFYTPH-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50080284   

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
DNA topoisomerase I (Topo I) (Homo sapiens (Human))	BDBM50080284 (6-(1-Hydroxy-propyl)-5,8-dimethoxy-[1,4]naphthoqui...) Show SMILES CCC(O)c1cc(OC)c2C(=O)C=CC(=O)c2c1OC |c:12| Show InChI InChI=1S/C15H16O5/c1-4-9(16)8-7-12(19-2)13-10(17)5-6-11(18)14(13)15(8)20-3/h5-7,9,16H,4H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.22E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chungnam National University Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of DNA topoisomerase-I of calf thymus				Bioorg Med Chem Lett 9: 2407-12 (1999) BindingDB Entry DOI: 10.7270/Q2TH8KVH
					More data for this Ligand-Target Pair