BDBM50033767 3,3',4',5',7-pentahydroxy flavone::3,7,3',4',5'-Pentahydroxyflavone::3,7-Dihydroxy-2-(3,4,5-trihydroxy-phenyl)-chromen-4-one::3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one::CHEMBL170405::NSC-407331::ROBINETIN::US11866416, Compound PAY

SMILES: c1cc2c(cc1O)OC(=C(C2=O)O)c3cc(c(c(c3)O)O)O

InChI Key: InChIKey=SOEDEYVDCDYMMH-UHFFFAOYSA-N

Data: 1 KI  5 IC50

PDB links: 1 PDB ID matches 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 6 hits for monomerid = 50033767   

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
Biofilm regulatory protein A (Streptococcus mutans serotype c (strain ATCC 70061...)	BDBM50033767 (CHEMBL170405 | 3,3',4',5',7-pentahydroxy flavone |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Xanthine dehydrogenase/oxidase (Bovine)	BDBM50033767 (CHEMBL170405 | 3,3',4',5',7-pentahydroxy flavone |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 (Human)	BDBM50033767 (CHEMBL170405 | 3,3',4',5',7-pentahydroxy flavone |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.79E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50033767 (CHEMBL170405 | 3,3',4',5',7-pentahydroxy flavone |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50033767 (CHEMBL170405 | 3,3',4',5',7-pentahydroxy flavone |...) 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
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Multidrug resistance-associated protein 1 (Human)	BDBM50033767 (CHEMBL170405 | 3,3',4',5',7-pentahydroxy flavone |...) Show SMILES Show InChI	GoogleScholar	UniChem		5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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