Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tributylmethylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 5/20 | 0.42 |
| ▸ | CES1 | P23141 | 5/20 | 0.42 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | PPARD | Q03181 | 2/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | LSS | P48449 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Tributylmethylammonium SCHEMBL4357063 | 0.92 | BBOX1 (0.52) | BBOX1CA1CES2CES1SLC22A1 | |
| Bicarbonate SCHEMBL7573774 | 0.91 | LSS (0.50) | BBOX1CES2CES1SLC22A1DNM1 | |
| Bicarbonate SCHEMBL29180238 | 0.91 | LSS (0.50) | BBOX1CES2CES1SLC22A1DNM1 | |
| Bicarbonate SCHEMBL9763312 | 0.91 | LSS (0.50) | BBOX1CES2CES1SLC22A1DNM1 | |
| Tributylmethylammonium SCHEMBL1052295 | 0.91 | BBOX1 (0.47) | BBOX1CA1CES2CES1SLC22A1 | |
| Tributylmethylammonium SCHEMBL557386 | 0.90 | BBOX1 (0.50) | BBOX1CA1CES2CES1SLC22A1 | |
| Tributylmethylammonium SCHEMBL1052293 | 0.90 | BBOX1 (0.50) | BBOX1CA1CES2CES1SLC22A1 | |
| Tributylmethylammonium SCHEMBL8995786 | 0.90 | BBOX1 (0.50) | BBOX1CA1CES2CES1SLC22A1 | |
| Tributylmethylammonium SCHEMBL4357067 | 0.90 | SLC22A1 (0.43) | BBOX1SLC22A1DNM1AKR1B1GPR84 | |
| Tributylmethylammonium SCHEMBL5570476 | 0.88 | BBOX1 (0.54) | BBOX1CA1CES2CES1SLC22A1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107710462-B | Electrochemical hydrogen storage electrode and battery | 巴斯夫公司 | 2022-08-02 | — | — | CN | claimed |
| EP-4717720-A1 | CATALYST COMPOSITION, BLOCKED POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, COATING FILM, AND METHOD FOR FORMING COATING FILM | Tosoh Corporation (JP) | 2026-04-01 | — | — | EP | disclosed |
| EP-4692150-A1 | CURABLE COMPOSITION AND CURED PRODUCT OF SAME | DIC Corporation (JP) | 2026-02-11 | — | — | EP | disclosed |
| EP-4678676-A1 | BLOCKED POLYISOCYANATE COMPOSITION, CURING AGENT FOR AQUEOUS COATING, AQUEOUS COATING COMPOSITION, AND COATING FILM | Tosoh Corporation (JP) | 2026-01-14 | — | — | EP | disclosed |
| WO-2024262553-A1 | CATALYST COMPOSITION, BLOCKED POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, COATING FILM, AND METHOD FOR FORMING COATING FILM | 東ソー株式会社 | 2024-12-26 | — | — | WO | disclosed |
| WO-2024209935-A1 | CURABLE COMPOSITION AND CURED PRODUCT OF SAME | DIC株式会社 | 2024-10-10 | — | — | WO | disclosed |
| WO-2024202500-A1 | BLOCKED POLYISOCYANATE COMPOSITION, CURING AGENT FOR AQUEOUS COATING, AQUEOUS COATING COMPOSITION, AND COATING FILM | 東ソー株式会社 | 2024-10-03 | — | — | WO | disclosed |
| CN-112159983-A | Silver plated part deplating method with deplating liquid capable of being recycled | 张少强 | 2021-01-01 | — | — | CN | disclosed |
| EP-0999206-B1 | Process for producing alpha cyano acetic acid esters | BASF AG (DE) | 2002-09-18 | — | — | EP | disclosed |
| EP-0999206-A1 | Process for producing alpha cyano acetic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2000-05-10 | — | — | EP | disclosed |
| EP-0671384-B1 | Process for the preparation of 3-cyano-3,5,5,-trimethyl-cyclohexanone | BASF AG (DE) | 1999-11-03 | — | — | EP | disclosed |
| US-5516928-A | REACTION OF ISOPHORONE AND HYDROGEN CYANIDE USING QUATERNARY AMMONIUM CATALYST | BASF AKTIENGESELLSCHAFT (DE) | 1996-05-14 | — | — | US | disclosed |
| EP-0671384-A1 | Process for the preparation of 3-cyano-3,5,5,-trimethyl-cyclohexanone | BASF AKTIENGESELLSCHAFT (DE) | 1995-09-13 | — | — | EP | disclosed |