Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 7/20 | 0.58 |
| ▸ | WNT3A | P56704 | 7/20 | 0.58 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.55 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.53 |
| ▸ | CA7 | P43166 | 3/20 | 0.53 |
| ▸ | CA9 | Q16790 | 3/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.53 |
| ▸ | HTR1B | P28222 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL827792 | 0.88 | CA12 (0.53) | CTNNB1WNT3ACA12CA1CA2 | |
| SCHEMBL2491600 | 0.85 | CTNNB1 (0.56) | CTNNB1WNT3ATAS1R3TAS1R1CA12 | |
| SCHEMBL22819676 | 0.84 | CTNNB1 (0.52) | CTNNB1WNT3ATAS1R3TAS1R1HTR1B | |
| SCHEMBL13516246 | 0.82 | CTNNB1 (0.60) | CTNNB1WNT3ATAS1R3TAS1R1HTR1B | |
| SCHEMBL14399373 | 0.82 | TAS1R3 (0.48) | CTNNB1WNT3ATAS1R3TAS1R1CA2 | |
| SCHEMBL826046 | 0.82 | HTR1B (0.59) | CTNNB1WNT3ATAS1R3TAS1R1CA12 | |
| SCHEMBL14369817 | 0.82 | CTNNB1 (0.50) | CTNNB1WNT3ATAS1R3TAS1R1HTR1B | |
| Hydrochloric Acid SCHEMBL29696055 | 0.81 | HTR1B (0.57) | CTNNB1WNT3ATAS1R3TAS1R1CA12 | |
| SCHEMBL27540475 | 0.80 | CTNNB1 (0.58) | CTNNB1WNT3ALMNACYP3A4MAPT | |
| SCHEMBL707407 | 0.79 | CA12 (0.67) | CA12CA1CA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119504431-A | Method for esterification of carboxylic acid and continuous flow photochemistry device | 国网安徽省电力有限公司电力科学研究院 | 2025-02-25 | — | — | CN | disclosed |
| CN-119504430-A | Carboxylic acid esterification method and gas-liquid mixed flow photochemical device | 国网安徽省电力有限公司电力科学研究院 | 2025-02-25 | — | — | CN | disclosed |
| CN-108884083-B | Benzo [ B ] furans as bromodomain inhibitors | 葛兰素史克知识产权第二有限公司 | 2022-02-25 | — | — | CN | disclosed |
| CN-109641908-A | Five-ring heterocycles simultaneously [3,4-d] pyridazinone compound, preparation method, pharmaceutical composition and its application | 中国科学院上海药物研究所 | 2019-04-16 | — | — | CN | disclosed |
| CN-107417687-A | Five-ring heterocycles simultaneously [3,4 d] pyridazinone compound, its preparation method, pharmaceutical composition and its application | 中国科学院上海药物研究所 | 2017-12-01 | — | — | CN | disclosed |
| WO-2004069840-A2 | PRODUCTION OF TETRAHYDROQUINOLINE BENZOFURANS | Grünenthal GmbH (DE) | 2004-08-19 | — | — | WO | disclosed |