BDBM50107009 5-Hydroxy-7-methyl-[1,4]naphthoquinone::5-hydroxy-7-methyl-1,4-naphthoquinone::7-methyljuglone::CHEMBL430853

SMILES: Cc1cc(O)c2C(=O)C=CC(=O)c2c1

InChI Key: InChIKey=OZUSCVSONBBWOR-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50107009   

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 gyrase (Mycobacterium tuberculosis)	BDBM50107009 (5-Hydroxy-7-methyl-[1,4]naphthoquinone | 5-hydroxy...) Show SMILES Cc1cc(O)c2C(=O)C=CC(=O)c2c1 |c:8| Show InChI InChI=1S/C11H8O3/c1-6-4-7-8(12)2-3-9(13)11(7)10(14)5-6/h2-5,14H,1H3	PDB MMDB B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
John Innes Centre					Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously.				J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase pim-1 (Homo sapiens (Human))	BDBM50107009 (5-Hydroxy-7-methyl-[1,4]naphthoquinone | 5-hydroxy...) Show SMILES Cc1cc(O)c2C(=O)C=CC(=O)c2c1 |c:8| Show InChI InChI=1S/C11H8O3/c1-6-4-7-8(12)2-3-9(13)11(7)10(14)5-6/h2-5,14H,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Xavier University of Louisiana Curated by ChEMBL					Assay Description Inhibition of recombinant human Pim1				Bioorg Med Chem Lett 26: 3187-91 (2016) BindingDB Entry DOI: 10.7270/Q2FQ9ZJ2
					More data for this Ligand-Target Pair
Human rhinovirus A protease (Human rhinovirus B)	BDBM50107009 (5-Hydroxy-7-methyl-[1,4]naphthoquinone | 5-hydroxy...) Show SMILES Cc1cc(O)c2C(=O)C=CC(=O)c2c1 |c:8| Show InChI InChI=1S/C11H8O3/c1-6-4-7-8(12)2-3-9(13)11(7)10(14)5-6/h2-5,14H,1H3	MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against HRV 3Cpro using HPLC assay				Bioorg Med Chem Lett 11: 3143-6 (2001) BindingDB Entry DOI: 10.7270/Q2T43SDG
					More data for this Ligand-Target Pair