BDBM50025321 2-(3,4-Dihydroxy-phenyl)-5-hydroxy-6,7-dimethoxy-chromen-4-one::2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-4H-chromen-4-one::5,3',4'-Trihydroxy-6,7-dimethoxyflavone::CHEMBL72637::Cirsiliol

SMILES: COc1cc2oc(cc(=O)c2c(O)c1OC)-c1ccc(O)c(O)c1

InChI Key: InChIKey=IMEYGBIXGJLUIS-UHFFFAOYSA-N

Data: 2 KI  2 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 4 hits for monomerid = 50025321   

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
Polyunsaturated fatty acid 5-lipoxygenase (Rat)	BDBM50025321 (2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-4H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
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Aldo-keto reductase family 1 member B1 (Rat)	BDBM50025321 (2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-4H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 1A1 (Human)	BDBM50025321 (2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-4H...) Show SMILES Show InChI	GoogleScholar	UniChem		>800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 1B1 (Human)	BDBM50025321 (2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-4H...) Show SMILES Show InChI	GoogleScholar	UniChem		>800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair