Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6183991 | 1.00 | TAAR1 (0.56) | TAAR1CYP1A2CYP2D6CYP2C19SLC6A4 | |
| SCHEMBL1989112 | 1.00 | TAAR1 (0.56) | TAAR1CYP1A2CYP2D6CYP2C19SLC6A4 | |
| Hydrochloric Acid SCHEMBL5877324 | 0.98 | TAAR1 (0.54) | TAAR1CYP1A2CYP2D6CYP2C19SLC6A4 | |
| SCHEMBL4615276 | 0.83 | ALDH1A1 (0.54) | TAAR1CYP1A2CYP2D6CYP2C19SLC6A4 | |
| SCHEMBL3006604 | 0.83 | TAAR1 (0.75) | TAAR1ALDH1A1AOC3HTR2AHTR2C | |
| SCHEMBL6575966 | 0.83 | ABCB11 (0.70) | CYP1A2MAPTABCB11 | |
| SCHEMBL18627978 | 0.83 | CYP1A2 (0.47) | TAAR1CYP1A2CYP2D6CYP2C19SLC6A4 | |
| SCHEMBL22291711 | 0.82 | CA1 (0.52) | CYP1A2CYP2D6CYP2C19SLC6A4CA1 | |
| SCHEMBL4454111 | 0.82 | CA1 (0.52) | CYP1A2CYP2D6CYP2C19SLC6A4CA1 | |
| Hydrochloric Acid SCHEMBL4615417 | 0.82 | ALDH1A1 (0.53) | TAAR1CYP1A2CYP2D6CYP2C19SLC6A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023191721-A2 | PRODUCTION OF ENANTIOPURE ALCOHOLS, AMINES AND ACIDS FROM ALKENES BY CASCADE BIOTRANSFORMATION INVOLVING 1,2-METHYL SHIFT | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2023-10-05 | — | — | WO | disclosed |
| EP-1828110-B8 | PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF | HOVIONE INT LTD (CH) | 2009-07-01 | — | — | EP | disclosed |
| EP-1828110-A1 | PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF | Hovione Inter Ltd. (CH) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006061549-A1 | PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF | HOVIONE INTER LTD. (CH) | 2006-06-15 | — | — | WO | disclosed |
| EP-1529038-A1 | BENZOTHIAZOLE DERIVATIVES HAVING BETA-2-ADRENORECEPTOR AGONIST ACTIVITY | Novartis AG (CH) | 2005-05-11 | — | — | EP | disclosed |
| WO-2004016601-A1 | BENZOTHIAZOLE DERIVATIVES HAVING BETA-2-ADRENORECEPTOR AGONIST ACTIVITY | NOVARTIS AG (CH) | 2004-02-26 | — | — | WO | disclosed |