Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.33 |
| ▸ | ALDH1A2 | O94788 | 3/20 | 0.33 |
| ▸ | ALDH1B1 | P30837 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12925985 | 0.78 | L3MBTL1 (0.49) | ALDH1A1KDM4EHPGDTHRBALDH2 | |
| SCHEMBL8310517 | 0.72 | CDK9 (0.36) | CDK9DYRK1ADYRK2ALDH2ALDH1A2 | |
| SCHEMBL3234704 | 0.71 | ADORA3 (0.43) | CDK9DYRK1ADYRK2ALDH1A1KDM4E | |
| SCHEMBL4958377 | 0.71 | ALDH2 (0.38) | ALDH1A1KDM4EHPGDCASP1CASP7 | |
| Hydrochloric Acid SCHEMBL8308661 | 0.71 | CDK9 (0.35) | CDK9DYRK1ADYRK2ALDH2ALDH1A2 | |
| SCHEMBL7082421 | 0.69 | TPMT (0.41) | ALDH1A1KDM4EHPGDCASP1CASP7 | |
| Hydrochloric Acid SCHEMBL7087423 | 0.68 | TPMT (0.39) | ALDH1A1KDM4EHPGDCASP1CASP7 | |
| SCHEMBL7086140 | 0.68 | ALDH2 (0.41) | ALDH1A1KDM4EHPGDCASP1CASP7 | |
| Oxalic Acid SCHEMBL8311094 | 0.67 | KMT2A (0.33) | ALDH1A1KDM4ETHRBALDH2ALDH1A2 | |
| SCHEMBL9205430 | 0.67 | ELANE (0.37) | ALDH1A1CA9CA1ALDH2TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0923575-A1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | Takeda Chemical Industries, Ltd. (JP) | 1999-06-23 | — | — | EP | disclosed |
| WO-1998008842-A1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-03-05 | — | — | WO | disclosed |