Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 1.00 |
| ▸ | CYP2C19 | P33261 | 4/20 | 1.00 |
| ▸ | CYP2C9 | P11712 | 2/20 | 1.00 |
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ACP3 | P15309 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7520769 | 0.87 | CYP1A2 (0.77) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL9867788 | 0.84 | CYP1A2 (0.71) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL8586266 | 0.84 | CYP1A2 (0.70) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL29281804 | 0.83 | CYP1A2 (0.70) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL9280807 | 0.82 | CYP1A2 (0.69) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL271106 | 0.82 | CYP1A2 (0.69) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL271107 | 0.82 | CYP1A2 (0.69) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL8813943 | 0.82 | CYP1A2 (0.69) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL5638078 | 0.81 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP2C9HTTMEN1 | |
| SCHEMBL27281987 | 0.80 | CYP1A2 (0.67) | CYP1A2CYP2C19CYP2C9HTTMEN1 |
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-111517902-B | Aerobic oxidation system containing sulfinic acid, sulfonic acid or derivatives thereof and photo-oxidation promoting method thereof | 清华大学 | 2022-06-14 | — | — | CN | disclosed |
| CN-111517902-A | Aerobic oxidation system containing sulfinic acid, sulfonic acid or derivatives thereof and photo-oxidation promoting method thereof | 清华大学 | 2020-08-11 | — | — | CN | disclosed |
| US-5247113-A | Curing agents or curing accelerators for epoxy resins | CIBA-GEIGY CORPORATION (US) | 1993-09-21 | — | — | US | disclosed |
| EP-0379464-B1 | ARALIPHATIC SULFONIUM SALTS AND THEIR USE | CIBA-GEIGY AG (CH) | 1993-02-10 | — | — | EP | disclosed |
| US-5013814-A | Araliphatic sulfonium salts and their use | CIBA-GEIGY CORPORATION (US) | 1991-05-07 | — | — | US | disclosed |
| EP-0379464-A1 | Araliphatic sulfonium salts and their use | CIBA-GEIGY AG (CH) | 1990-07-25 | — | — | EP | disclosed |
| US-4783562-A | Process for the preparation of trichloromethyl-substituted aromatic compounds, and trichloromethyl-substituted aromatic compounds obtained in this process | BAYER AKTIENGESELLSCHAFT (DE) | 1988-11-08 | — | — | US | disclosed |
| US-4505860-A | Cyclic keto-butyraldehydes a process for their preparation, and their use in the preparation of cyclic diisocyanates | BAYER AKTIENGESELLSCHAFT (DE) | 1985-03-19 | — | — | US | disclosed |
| EP-0100479-B1 | 3-(AMINOMETHYL)-1-(3-AMINOPROPYL-1-METHYL)-4-METHYL CYCLOHEXANE, PROCESS FOR ITS PREPARATION AND ITS USE | BAYER AG (DE) | 1985-03-13 | — | — | EP | disclosed |
| US-4487966-A | 3-Aminomethyl-1-(3-aminopropyl-1-methyl)-4-methylcyclohexane, a process for its preparation and its use | BAYER AKTIENGESELLSCHAFT (DE) | 1984-12-11 | — | — | US | disclosed |
| EP-0008763-B1 | AMINOMETHYL-CYCLODODECANES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTICORROSIVES | BAYER AG (DE) | 1981-04-01 | — | — | EP | disclosed |
| US-4251462-A | REACTING 1,5,9-CYCLODODECATRIENE WITH CARBON MONOXIDE AND HYDROGEN, REMOVING CATALYST, REACTING WITH HYDROGEN AND AMMONIA | BAYER AKTIENGESELLSCHAFT (DE) | 1981-02-17 | — | — | US | disclosed |
| EP-0008763-A1 | Aminomethyl-cyclododecanes, a process for their preparation and their use as anticorrosives | BAYER AG (DE) | 1980-03-19 | — | — | EP | disclosed |