BDBM23446 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one::CHEMBL45068::Phloretin::US20250213569, Compound 38::cid_4788

SMILES: c1cc(ccc1CCC(=O)c2c(cc(cc2O)O)O)O

InChI Key: InChIKey=VGEREEWJJVICBM-UHFFFAOYSA-N

Data: 2 KI  14 IC50  1 Kd  1 EC50  6 ITC

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 18 hits for monomerid = 23446   

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
Monocarboxylate transporter 1 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium/glucose cotransporter 1 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) 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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Sodium/glucose cotransporter 2 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 2, facilitated glucose transporter member 1 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Monocarboxylate transporter 1 (Rat)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Monocarboxylate transporter 2 (Rat)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Epidermal growth factor receptor (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.50E+7	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase 33 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.14E+4	n/a	n/a	n/a	n/a
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Sortase B (Staphylococcus aureus subsp. aureus NCTC 8325)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Transthyretin (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a
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Beta-lactamase (Enterobacter cloacae)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.96E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Chymotrypsinogen A (Bovine)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Monocarboxylate transporter 4 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
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DNA topoisomerase 2-alpha (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.67E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Pancreatic triacylglycerol lipase (Pig)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (2019-nCoV)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.35E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier family 28 member 3 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		3.23E+4	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
Sodium/glucose cotransporter 1 (Human)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...) Show SMILES Show InChI	GoogleScholar	UniChem		8.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Activity Spreadsheet -- ITC Data from BindingDB

Found 6 hits for monomerid = 23446

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Transcriptional Regulator TtgR (Pseudomonas putida)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)	GoogleScholar			-8.25	7.43	-15.7	5.95	7	30
TBA					Details of this binding reaction
Transcriptional Regulator TtgR (Pseudomonas putida)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)	GoogleScholar			-6.87	-4.88	-1.99	4.96	7	30
TBA					Details of this binding reaction
Transcriptional Regulator TtgR (Pseudomonas putida)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)	GoogleScholar			-8.29	8.70	-17.0	5.99	7	30
TBA					Details of this binding reaction
Transcriptional Regulator TtgR-DNA (Pseudomonas putida)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)	GoogleScholar			-8.74	10.4	-19.2	6.31	7	30
TBA					Details of this binding reaction
Transcriptional Regulator TtgR (Pseudomonas putida)	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)	GoogleScholar			-10.2	4.89	-15.1	7.32	7	30
TBA					Details of this binding reaction
Transcriptional Regulator TtgR Mutant R176G (Pseudomonas putida (g-Proteobacteria))	BDBM23446 (3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop...)	GoogleScholar			-6.99	14.6	-21.6	5.04	7	30
TBA					Details of this binding reaction