BDBM24777 5-hydroxy-1,4-dihydronaphthalene-1,4-dione::5-hydroxy-1,4-naphthoquinone, 4::CHEMBL43612::Juglone::Juglone (6a)

SMILES: c1cc2c(c(c1)O)C(=O)C=CC2=O

InChI Key: InChIKey=KQPYUDDGWXQXHS-UHFFFAOYSA-N

Data: 22 IC50  2 EC50

PDB links: 6 PDB IDs match this monomer.

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 24 hits for monomerid = 24777   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
DNA topoisomerase 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Dual specificity protein phosphatase 1 (Mouse)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Dual specificity protein phosphatase 6 (Rat)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
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M-phase inducer phosphatase 2 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Protein disulfide-isomerase A4 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Protein disulfide-isomerase A3 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Protein disulfide-isomerase (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Protein disulfide-isomerase (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Aurora kinase B (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
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Aurora kinase A (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Indoleamine 2,3-dioxygenase 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	6.5	37
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Transient receptor potential cation channel subfamily A member 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a
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Transient receptor potential cation channel subfamily A member 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
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5-lipoxygenase (Bovine)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
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3-hydroxyacyl-[acyl-carrier-protein] dehydratase FabZ (Francisella tularensis)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	7.0	25
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3-hydroxyacyl-[acyl-carrier-protein] dehydratase FabZ [1-175] (Yersinia pestis)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	7.0	25
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Amine oxidase (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] A (Human)	BDBM24777 (5-hydroxy-1,4-dihydronaphthalene-1,4-dione | CHEMB...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
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