Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.39 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | PSMB8 | P28062 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27895311 | 0.98 | DYRK1A (0.47) | DYRK1ATSHRGRIA1CACNG8TRPV4 | |
| SCHEMBL101977 | 0.98 | DYRK1A (0.47) | DYRK1ATSHRGRIA1CACNG8TRPV4 | |
| Fluoride SCHEMBL27502055 | 0.95 | DYRK1A (0.46) | DYRK1ATSHRGRIA1CACNG8TRPV4 | |
| Hydroxyamine SCHEMBL28229541 | 0.89 | DYRK1A (0.42) | DYRK1ATSHRGRIA1CACNG8TRPV4 | |
| Bicarbonate SCHEMBL28187410 | 0.87 | TSHR (0.48) | DYRK1ATSHRGRIA1CACNG8KDM4E | |
| SCHEMBL11099454 | 0.86 | TSHR (0.52) | DYRK1ATSHRGRIA1CACNG8HTR2A | |
| SCHEMBL3237062 | 0.85 | TSHR (0.46) | DYRK1ATSHRTRPV4HTR2ACA1 | |
| Acetic Acid SCHEMBL28836539 | 0.84 | TSHR (0.46) | DYRK1ATSHRGRIA1CACNG8KDM4E | |
| SCHEMBL12017294 | 0.84 | MAOA (0.48) | DYRK1ATSHRCA2KDM4EALDH1A1 | |
| SCHEMBL28523518 | 0.83 | KCNH2 (0.42) | DYRK1ATSHRGRIA1CACNG8TRPV4 |
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-111454167-A | Method for synthesizing 4- (trifluoromethyl) 2, 4-pentadiene amide | 西安工程大学 | 2020-07-28 | — | — | CN | claimed |
| CN-112851508-B | In Ballon Sha Wei Process for the preparation of intermediates | 广东东阳光药业股份有限公司 | 2025-02-25 | — | — | CN | disclosed |
| CN-111454167-A | Method for synthesizing 4- (trifluoromethyl) 2, 4-pentadiene amide | 西安工程大学 | 2020-07-28 | — | — | CN | disclosed |
| US-5272202-A | Hydrogenation process of unsaturated, nitrile-group-containing polymer and aqueous emulsion of hydrogenated polymer | NIPPON ZEON CO., LTD. (JP) | 1993-12-21 | — | — | US | disclosed |