BDBM23417 α-CA inhibitor, 4::(-)-Epicatechin::(2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol::Epicatechin::L-Epicatechin::cid_72276

SMILES: c1cc(c(cc1[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)O)O)O

InChI Key: InChIKey=PFTAWBLQPZVEMU-UHFFFAOYSA-N

Data: 7 KI  24 IC50  2 Kd  3 EC50  1 Other

PDB links: 4 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 37 hits for monomerid = 23417   

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
Prostaglandin G/H synthase 1 (Sheep)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.59E+4	n/a	n/a	n/a	n/a	n/a
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Beta-secretase 1 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amyloid-beta precursor protein (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Fatty acid synthase (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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6-phosphogluconate dehydrogenase, decarboxylating (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Glucose-6-phosphate 1-dehydrogenase (Baker's yeast)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Aldo-keto reductase family 1 member B1 (Rat)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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DNA polymerase beta (Rat)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Pyruvate kinase PKM (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Prostaglandin G/H synthase 1 (Sheep)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Prostaglandin G/H synthase 1 (Sheep)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Xanthine dehydrogenase/oxidase (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Nitric oxide synthase, endothelial (Bovine)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
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Arginase (Leishmania amazonensis)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) 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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Sucrase-isomaltase, intestinal (Rat)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Prothrombin (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	5.19E+6	n/a	n/a	n/a	n/a	n/a
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Prothrombin (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-synuclein (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
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M18 aspartyl aminopeptidase (Plasmodium falciparum (isolate 3D7))	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Procathepsin L (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Intestinal-type alkaline phosphatase 1 (Rat)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Intestinal-type alkaline phosphatase (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
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Alkaline phosphatase, germ cell type (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	5.13E+4	n/a	n/a	n/a	n/a
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Alkaline phosphatase, tissue-nonspecific isozyme (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	407	n/a	n/a	n/a	n/a	n/a	n/a
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Mitogen-activated protein kinase 14 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.76E+4	n/a	n/a	n/a	n/a	n/a	37
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Mitogen-activated protein kinase 10 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.95E+4	n/a	n/a	n/a	n/a	n/a	37
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Anthrax toxin receptor 2 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) 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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Alpha-synuclein (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-amylase 1A (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	n/a	n/a	n/a	6.0	22
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Arginase (Leishmania amazonensis)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Carbonic anhydrase 2 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		1.24E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 1 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		2.32E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 4 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 6 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		4.36E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 3 (Bovine)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		8.93E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Apoptosis regulator Bcl-2 (Human)	BDBM23417 (cid_72276 | (-)-Epicatechin | (2R,3R)-2-(3,4-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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