Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Toluene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | TSHR | P16473 | 2/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.65 |
| ▸ | ACHE | P22303 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL11123126 | 1.00 | LMNA (0.65) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL3670161 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL2904564 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL27784842 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL6518753 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL3973760 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL28004549 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL5070324 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL7627695 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 | |
| Toluene SCHEMBL28219186 | 0.97 | LMNA (0.61) | LMNATSHRALOX12ACHESMN1; SMN2 |
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 1630 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11802117-B2 | Conversion of CBD to D8-THC to D6a10a-THC | SIEGEL ALEXANDER WILLIAM (US) | 2023-10-31 | — | — | US | claimed |
| WO-2023143576-A1 | CRYSTALLINE FORM OR AMORPHOUS FORM OF MACROCYCLIC COMPOUND OR SALT OR SOLVATE THEREOF | 苏州亚盛药业有限公司 | 2023-08-03 | — | — | WO | claimed |
| CN-116514814-A | Crystalline or amorphous forms of macrocyclic compounds or salts, solvates thereof | 苏州亚盛药业有限公司 | 2023-08-01 | — | — | CN | claimed |
| US-11702616-B2 | Metal complexes and dishwashing detergents containing them | HENKEL AG & CO. KGAA (DE) | 2023-07-18 | — | — | US | claimed |
| WO-2023117380-A1 | METAL COMPLEXES, AND DISHWASHING PRODUCTS CONTAINING SAME | HENKEL AG & CO. KGAA (DE) | 2023-06-29 | — | — | WO | claimed |
| EP-3872157-B1 | DISHWASHING COMPOSITIONS CONTAINING METAL COMPLEXES | HENKEL AG & CO KGAA (DE) | 2022-12-28 | — | — | EP | claimed |
| CN-115028429-B | Application of desulfurized sludge in fly ash plate | 京能电力涿州科技环保有限公司 | 2022-11-18 | — | — | CN | claimed |
| CN-115028429-A | Application of desulfurized sludge in fly ash plate | 京能电力涿州科技环保有限公司 | 2022-09-09 | — | — | CN | claimed |
| US-11208559-B2 | Modified indigo compounds and methods of dyeing a substrate using a modified indigo compound | THE H.D. LEE COMPANY, INC. (US) | 2021-12-28 | — | — | US | claimed |
| EP-2455109-B2 | Gelatin-transglutaminase hemostatic dressings and sealants | LIFEBOND LTD (IL) | 2021-11-03 | — | — | EP | claimed |
| US-5223323-A | Applying aqueous varnish of melamine resin, urea resin, polyol, self-crosslinking polyacrylate dispersion, filler, acidic curing catalyst; baking | BASF CORPORATION (US) | 1993-06-29 | — | — | US | claimed |
| US-5216125-A | Active ester used for production of acylated amino acids | SANSHIN KAGAKU KOGYO CO. LTD. (JP) | 1993-06-01 | — | — | US | claimed |
| US-5147876-A | Nervous system disorders | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-09-15 | — | — | US | claimed |
| EP-0331988-A1 | Sulfonium compounds, as well as process for producing active esters and amides used for the production of amides | SANSHIN KAGAKU KOGYO CO., LTD. (JP) | 1989-09-13 | — | — | EP | claimed |
| US-4855445-A | Substituted-8-alkenyl-1,3,4,9-tetrahydropyrano[3,4-b]indole-1-acetic acids | AMERICAN HOME PRODUCTS CORPORATION (US) | 1989-08-08 | — | — | US | claimed |
| US-4832856-A | CATIONIC SURFACTANTS, ANIONIC SURFACTANTS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1989-05-23 | — | — | US | claimed |
| US-4699979-A | 7-amino-3-propenylcephalosporanic acid and esters thereof | BRISTOL-MEYERS COMPANY (US) | 1987-10-13 | — | — | US | claimed |
| US-4689292-A | ORTHOCHROMATIC DYE SENSITIZERS | KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) | 1987-08-25 | — | — | US | claimed |
| EP-0140309-A2 | Process for the preparation of copolymers of monoallylamine and diallylamine derivatives | NITTO BOSEKI CO., LTD. (JP) | 1985-05-08 | — | — | EP | claimed |
| EP-0078349-A1 | Antibiotic novel dianemycin derivative | TAISHO PHARMACEUTICAL CO. LTD (JP) | 1983-05-11 | — | — | EP | claimed |