3,4,5-Trimethoxybenzoic Acid

3,4,5-Trimethoxybenzoic Acid

SCHEMBL9739811

COc1cc(C(=O)[O-])cc(OC)c1OC.[Li+]

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of 3,4,5-Trimethoxybenzoic Acid. 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
▸ TUBB4A P04350 3/20 0.53
▸ TUBB P07437 3/20 0.53
▸ TUBA3C P0DPH7 3/20 0.53
▸ TUBA1B P68363 3/20 0.53
▸ TUBA4A P68366 3/20 0.53
▸ TUBB4B P68371 3/20 0.53
▸ TUBB3 Q13509 3/20 0.53
▸ TUBB2A Q13885 3/20 0.53
▸ TUBB8 Q3ZCM7 3/20 0.53
▸ TUBA3E Q6PEY2 3/20 0.53
▸ TUBA1A Q71U36 3/20 0.53
▸ TUBA1C Q9BQE3 3/20 0.53
▸ TUBB6 Q9BUF5 3/20 0.53
▸ TUBB2B Q9BVA1 3/20 0.53
▸ TUBB1 Q9H4B7 3/20 0.53
▸ TPMT P51580 1/20 0.52
▸ KMT2A Q03164 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ MAPT P10636 3/20 0.50
▸ ABCG2 Q9UNQ0 1/20 0.50

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
3,4,5-Trimethoxybenzoic Acid SCHEMBL11023599 0.96 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
3,4,5-Trimethoxybenzoic Acid SCHEMBL10838605 0.96 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
3,4,5-Trimethoxybenzoic Acid SCHEMBL10876051 0.86 ALDH1A1 (0.58) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4819729 0.80 TUBB4A (0.75) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4625442 0.80 TUBB1 (0.58) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Syringic Acid SCHEMBL7700213 0.79 PKM (0.64) TPMTKMT2AMEN1MAPTCYP3A4
SCHEMBL4089388 0.78 TUBB4A (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
3,4,5-Trimethoxybenzoic Acid SCHEMBL6592 0.78 TPMT (0.78) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Hydrochloric Acid SCHEMBL27888195 0.78 TUBB4A (0.72) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL290542 0.78 LMNA (0.69) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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
US-5098477-A Aromatic ether derivatives as light stabilizers for organic materials CIBA-GEIGY CORPORATION (US) 1992-03-24 — — US claimed
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