Ferulate

Ferulate

SCHEMBL29124088

CCO.COc1cc(C=CC(=O)O)ccc1O

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Ferulate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP13 known ✓ P45452 1/20 0.71
▸ MMP8 known ✓ P22894 1/20 0.64
▸ KDM4E B2RXH2 4/20 0.88
▸ CA12 O43570 2/20 0.88
▸ CA1 P00915 2/20 0.88
▸ CA2 P00918 2/20 0.88
▸ CA3 P07451 2/20 0.88
▸ PKM P14618 2/20 0.88
▸ CA4 P22748 2/20 0.88
▸ CA6 P23280 2/20 0.88
▸ CA5A P35218 2/20 0.88
▸ SNCA P37840 2/20 0.88
▸ CA7 P43166 2/20 0.88
▸ CA9 Q16790 2/20 0.88
▸ CA14 Q9ULX7 2/20 0.88
▸ CA5B Q9Y2D0 2/20 0.88
▸ CSNK2A2 P19784 1/20 0.88
▸ CSNK2B P67870 1/20 0.88
▸ CSNK2A1 P68400 1/20 0.88
▸ CSNK2A3 Q8NEV1 1/20 0.88

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
Ferulate SCHEMBL5704520 1.00 KDM4E (0.88) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL30760602 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL15674 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL29365367 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL1703377 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL29481134 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL29362602 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL30880441 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL1908219 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3
Ferulate SCHEMBL30210805 0.94 KDM4E (1.00) KDM4ECA12CA1CA2CA3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117990912-A Method for detecting concentration of ferulic acid 浙江理工大学绍兴生物医药研究院有限公司 2024-05-07 — — CN claimed
CN-117820732-A Ferulic acid cyclodextrin inclusion compound, preparation method thereof and method for enhancing water-retaining property of myofibrillar protein hydrogel 北京工商大学 2024-04-05 — — CN claimed
CN-118223296-A Method for preparing waterproof breathable fabric from regenerated polyester fibers 安徽亿盈特纤新材料有限公司 2024-06-21 — — CN disclosed
CN-117990912-A Method for detecting concentration of ferulic acid 浙江理工大学绍兴生物医药研究院有限公司 2024-05-07 — — CN disclosed
CN-117820732-A Ferulic acid cyclodextrin inclusion compound, preparation method thereof and method for enhancing water-retaining property of myofibrillar protein hydrogel 北京工商大学 2024-04-05 — — CN disclosed
CN-115058034-B Chitosan-ferulic acid copolymer active membrane and preparation method and application thereof 湖南省农产品加工研究所 2023-09-19 — — CN disclosed
CN-115058034-A Chitosan-ferulic acid copolymer active membrane and preparation method and application thereof 湖南省农产品加工研究所 2022-09-16 — — CN disclosed
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