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(-)-Epicatechin

(-)-Epicatechin

SCHEMBL29137174

O=C(OC(=O)c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1.Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2.Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2

nearest known ligand 0.78

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYNJ2 O15056 3/20 0.78
▸ BACE1 P56817 8/20 0.73
▸ KDM4E B2RXH2 6/20 0.73
▸ PKM P14618 4/20 0.73
▸ HSD17B10 Q99714 4/20 0.73
▸ MAPT P10636 4/20 0.73
▸ RECQL P46063 4/20 0.73
▸ SNCA P37840 4/20 0.73
▸ MEN1 O00255 3/20 0.73
▸ KMT2A Q03164 3/20 0.73
▸ GAA P10253 3/20 0.73
▸ ALDH1A1 P00352 3/20 0.73
▸ APEX1 P27695 3/20 0.73
▸ ALOX15 P16050 3/20 0.73
▸ TDP1 Q9NUW8 3/20 0.73
▸ APP P05067 2/20 0.73
▸ CYP3A4 P08684 2/20 0.73
▸ RAD52 P43351 2/20 0.73
▸ ALPL P05186 2/20 0.73
▸ POLB P06746 2/20 0.73

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
(-)-Epicatechin SCHEMBL27800385 1.00 SYNJ2 (0.78) SYNJ2BACE1KDM4EPKMHSD17B10
Cianidanol SCHEMBL21611697 1.00 SYNJ2 (0.78) SYNJ2BACE1KDM4EPKMHSD17B10
Cianidanol SCHEMBL28937698 1.00 SYNJ2 (0.78) SYNJ2BACE1KDM4EPKMHSD17B10
(-)-Epicatechin SCHEMBL28052336 0.92 SYNJ2 (0.67) SYNJ2BACE1KDM4EPKMHSD17B10
Cianidanol SCHEMBL28452121 0.91 SYNJ2 (0.80) SYNJ2BACE1KDM4EPKMHSD17B10
(-)-Epicatechin SCHEMBL29025606 0.90 SYNJ2 (0.72) SYNJ2BACE1KDM4EPKMHSD17B10
Cianidanol SCHEMBL144001 0.89 BACE1 (0.76) SYNJ2BACE1KDM4EPKMHSD17B10
Catechin SCHEMBL7198386 0.89 BACE1 (0.76) SYNJ2BACE1KDM4EPKMHSD17B10
Cianidanol SCHEMBL7538738 0.89 BACE1 (0.76) SYNJ2BACE1KDM4EPKMHSD17B10
(-)-Epicatechin SCHEMBL19971115 0.89 BACE1 (0.76) SYNJ2BACE1KDM4EPKMHSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115029326-B Enzyme cross-linked aggregate and preparation method and application thereof 湖南福来格生物技术有限公司 2024-01-02 — — CN disclosed