BDBM50133496 (2R)-3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid::(R)-rosmarinic acid::CHEMBL324842::Rosmarinic acid, 2::US10688093, Compound rosmarinic acid::US11701353, rosmarinic acid::cid_5281792

SMILES: c1cc(c(cc1C[C@H](C(=O)O)OC(=O)/C=C/c2ccc(c(c2)O)O)O)O

InChI Key: InChIKey=DOUMFZQKYFQNTF-UHFFFAOYSA-N

Data: 2 KI  30 IC50  2 Kd  4 EC50

PDB links: 5 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 39 hits for monomerid = 50133496   

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
Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Induced myeloid leukemia cell differentiation protein Mcl-1 (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Aldo-keto reductase family 1 member B1 (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Hyaluronidase-1 (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.45E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Polyphenol oxidase 2 (White button mushroom)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) 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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Integrase (Human immunodeficiency virus type 1)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) 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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Integrase (Human immunodeficiency virus type 1)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
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72 kDa type IV collagenase (Rat)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Proto-oncogene tyrosine-protein kinase Src (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Lck (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Interstitial collagenase (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Transcription factor Jun (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Transthyretin (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a
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Amyloid-beta precursor protein (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Linoleate 9S-lipoxygenase-4 (Soybean)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.15E+6	n/a	n/a	n/a	n/a	n/a	25
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amyloid-beta precursor protein (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.03E+4	n/a	n/a	n/a	n/a
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17-beta-hydroxysteroid dehydrogenase type 2 (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) 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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Integrase (Human immunodeficiency virus type 1)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
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Aldo-keto reductase family 1 member B1 (Rat)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.89E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Amyloid-beta precursor protein (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	5.72E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Amyloid-beta precursor protein (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	6.81E+4	n/a	n/a	n/a	n/a
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Alpha-synuclein (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Lck (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Lysine-specific histone demethylase 1A (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
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UDP-galactopyranose mutase (Pseudomonas aeruginosa (g-Proteobacteria))	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	6.90E+4	n/a	n/a	n/a	n/a	n/a
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UDP-galactopyranose mutase (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	6.53E+5	n/a	n/a	n/a	n/a	n/a
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Lysine-specific histone demethylase 1A (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Tyrosine-protein kinase Fyn (Human)	BDBM50133496 (Rosmarinic acid, 2 | cid_5281792 | CHEMBL324842 | ...) Show SMILES Show InChI	GoogleScholar	UniChem		1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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