BDBM67454 1,2,4-trihydroxy-9,10-anthraquinone::1,2,4-trihydroxyanthracene-9,10-dione::1,2,4-tris(oxidanyl)anthracene-9,10-dione::MLS002473304::SMR001306802::cid_6683::hsp90_173::purpurin

SMILES: c1ccc2c(c1)C(=O)c3c(cc(c(c3C2=O)O)O)O

InChI Key: InChIKey=BBNQQADTFFCFGB-UHFFFAOYSA-N

Data: 2 KI  18 IC50  2 Kd

PDB links: 3 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 22 hits for monomerid = 67454   

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
Protein Rev (Human immunodeficiency virus type 1)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>7.54E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] B (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] A (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Acetylcholinesterase (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
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Death-associated protein kinase 1 (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
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Cell division protein FtsZ (Bacillus subtilis)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a
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Cell division protein FtsZ (Escherichia coli (strain K12))	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] B (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] A (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Transthyretin (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Co-chaperonin GroES (Escherichia coli)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Chaperonin GroEL (Escherichia coli)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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60 kDa heat shock protein, mitochondrial (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Co-chaperonin GroES (Escherichia coli)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Thiosulfate sulfurtransferase (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] A (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 1B1 (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 1A1 (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Heat shock protein HSP 90-beta (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Female germline-specific tumor suppressor gld-1 (Caenorhabditis elegans)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amine oxidase [flavin-containing] A (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		422	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 1B1 (Human)	BDBM67454 (MLS002473304 | purpurin | 1,2,4-tris(oxidanyl)anth...) Show SMILES Show InChI	GoogleScholar	UniChem		700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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