Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.31 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL7721181 | 0.84 | THRB (0.33) | ALDH1A1PKMTSHR | |
| Methyl Alcohol SCHEMBL8650747 | 0.83 | — | — | |
| SCHEMBL198 | 0.83 | — | — | |
| SCHEMBL21373228 | 0.83 | — | — | |
| SCHEMBL11480259 | 0.83 | — | — | |
| Trichloroacetic Acid SCHEMBL9118126 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TSHR | |
| Water SCHEMBL2170632 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL20601961 | 0.80 | — | — | |
| SCHEMBL18813405 | 0.80 | — | — | |
| SCHEMBL9063657 | 0.79 | CA2 (0.32) | PKM |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118105546-A | Novel bone repair stent printed by low-temperature 3D (three-dimensional) printing and preparation method and application thereof | 大连医科大学附属第一医院 | 2024-05-31 | — | — | CN | claimed |
| CN-117771450-A | Preparation method and application of TPG/PLGA/PCL nanofiber barrier membrane | 南京医科大学附属口腔医院 | 2024-03-29 | — | — | CN | claimed |
| CN-118105546-A | Novel bone repair stent printed by low-temperature 3D (three-dimensional) printing and preparation method and application thereof | 大连医科大学附属第一医院 | 2024-05-31 | — | — | CN | disclosed |
| CN-118105546-A | Novel bone repair stent printed by low-temperature 3D (three-dimensional) printing and preparation method and application thereof | 大连医科大学附属第一医院 | 2024-05-31 | — | — | CN | disclosed |
| CN-117771450-A | Preparation method and application of TPG/PLGA/PCL nanofiber barrier membrane | 南京医科大学附属口腔医院 | 2024-03-29 | — | — | CN | disclosed |
| CN-109438205-B | Synthesis method of 2-methyl-2, 3-diaryl propionaldehyde derivative | 西北大学 | 2021-11-12 | — | — | CN | disclosed |
| US-10865163-B2 | Carbon dioxide as a directing group for C—H functionalization reactions involving Lewis basic amines, alcohols, thiols, and phosphines for the synthesis of compounds | THE UNIVERSITY OF TOLEDO (US) | 2020-12-15 | — | — | US | disclosed |
| US-20190185392-A1 | Carbon Dioxide as a Directing Group for C-H Functionalization Reactions Involving Lewis Basic Amines, Alcohols, Thiols, and Phosphines for the Synthesis of Compounds | THE UNIVERSITY OF TOLEDO (US) | 2019-06-20 | — | — | US | disclosed |
| CN-101087754-B | Cyclohexane derivatives | HOFFMANN LA ROCHE | 2012-01-18 | — | — | CN | disclosed |
| US-20110002945-A1 | Use of immunoglobulin heavy and light chains or fragments thereof to bind to aggregated amyloidogenic proteins | THOMAS JEFFERSON UNIVERSITY | 2011-01-06 | — | — | US | disclosed |
| CN-101087754-A | Novel cyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2007-12-12 | — | — | CN | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20190185392-A1 | Carbon Dioxide as a Directing Group for C-H Functionalization Reactions Involving Lewis Basic Amines, Alcohols, Thiols, and Phosphines for the Synthesis of Compounds | CHKB, HRH3, PNMT | FFAR3 3711/4885LCK 2102/4885FYN 1887/4885 |
| US-10865163-B2 | Carbon dioxide as a directing group for C—H functionalization reactions involving Lewis basic amines, alcohols, thiols, and phosphines for the synthesis of compounds | CHKB, HRH3, PNMT | FFAR3 3737/4885LCK 2156/4885FYN 1984/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.