Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA7 | P43166 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | CA6 | P23280 | 2/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1432436 | 0.89 | ALDH1A1 (0.48) | ALDH1A1LCKFYNKDM4EHPGD | |
| SCHEMBL1286669 | 0.74 | HTT (0.48) | ALDH1A1KDM4EHPGDMAPTHTT | |
| Bicarbonate SCHEMBL6617803 | 0.72 | CA12 (0.43) | ALDH1A1LCKFYNKDM4EHPGD | |
| SCHEMBL3063642 | 0.72 | ALDH1A1 (0.35) | ALDH1A1LCKFYNKDM4EHPGD | |
| SCHEMBL5010451 | 0.72 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDTDP1HTT | |
| SCHEMBL6766241 | 0.72 | KDM4E (0.48) | ALDH1A1KDM4EHPGDMAPTHTT | |
| SCHEMBL11480822 | 0.71 | KDM4E (0.53) | ALDH1A1KDM4EHPGDMAPTTDP1 | |
| SCHEMBL11468242 | 0.69 | TSHR (0.51) | ALDH1A1KDM4EHPGDTDP1HTT | |
| SCHEMBL28214536 | 0.69 | ALDH1A1 (0.49) | ALDH1A1HPGDTDP1CA12CA1 | |
| SCHEMBL5957194 | 0.68 | PRSS1 (0.36) | ALDH1A1HPGDCA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0255297-B1 | AZABICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE | BEECHAM GROUP PLC (GB) | 1993-04-21 | — | — | EP | disclosed |
| US-4808588-A | HEADACHES, CENTRAL NERVOUS SYSTEM DISORDERS, ANTIARRHYTHMIA ANTIEMETIC AGENTS | BEECHAM GROUP, P.L.C. (GB) | 1989-02-28 | — | — | US | disclosed |
| EP-0255297-A2 | Azabicyclic compounds, process for their preparation, and their pharmaceutical use | BEECHAM GROUP PLC (GB) | 1988-02-03 | — | — | EP | disclosed |