Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 11/20 | 0.57 |
| ▸ | HSD17B2 | P37059 | 11/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | MGAM | O43451 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | SI | P14410 | 1/20 | 0.49 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL27736524 | 0.88 | HSD17B1 (0.50) | HSD17B1HSD17B2CYP3A4CYP2C9ACHE | |
| SCHEMBL29561382 | 0.84 | MEN1 (0.48) | HSD17B1HSD17B2CYP3A4CYP2C9ACHE | |
| SCHEMBL12565770 | 0.83 | HTR7 (0.53) | CYP3A4ACHEALDH1A1CA2CA9 | |
| SCHEMBL4284518 | 0.79 | HSD17B1 (0.46) | HSD17B1HSD17B2CYP3A4CYP2C9ACHE | |
| SCHEMBL6564927 | 0.79 | CA12 (0.53) | HSD17B1HSD17B2CYP3A4CYP2C9CA12 | |
| SCHEMBL1031494 | 0.78 | ESR2 (0.57) | HSD17B1HSD17B2CYP3A4CYP2C9ACHE | |
| SCHEMBL69369 | 0.77 | HSD17B1 (0.88) | HSD17B1HSD17B2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL29551999 | 0.77 | HSD17B1 (0.88) | HSD17B1HSD17B2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL11359920 | 0.77 | HSD17B1 (0.52) | HSD17B1HSD17B2CYP3A4CYP2C9ACHE | |
| SCHEMBL22393684 | 0.77 | HSD17B1 (0.50) | HSD17B1HSD17B2CYP3A4CYP2C9ACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107176944-B | Thiophene carboxylic acid compound or derivative thereof, pharmaceutical composition, preparation method and application thereof | 中国科学院上海药物研究所 | 2020-05-01 | — | — | CN | disclosed |
| WO-2015024448-A1 | BENZO PIPERIDINE RING AND BENZO MORPHOLINE RING COMPOUNDS, MANUFACTURING METHOD THEREFOR, AND MEDICAL APPLICATIONS THEREOF | 上海润诺生物科技有限公司 (CN) | 2015-02-26 | — | — | WO | disclosed |
| US-4792570-A | 3- and 4-biphenyloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents | SYNTEX (U.S.A.) INC. (US) | 1988-12-20 | — | — | US | disclosed |
| EP-0157652-A1 | 2-, 3- And 4-biphenyloxyaminoalkanes and related compounds, their preparation and uses, and pharmaceutical compositions containing them | SYNTEX (U.S.A.) INC. (US) | 1985-10-09 | — | — | EP | disclosed |