Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR5 | P32302 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.43 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | SLC37A4 | O43826 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10936470 | 0.90 | ALDH1A1 (0.50) | CXCR5ALDH1A1PRSS1PRSS2PRSS3 | |
| SCHEMBL5609680 | 0.88 | CXCR5 (0.59) | CXCR5ALDH1A1CYSLTR2CYSLTR1KDM4E | |
| SCHEMBL27958078 | 0.85 | ALDH1A1 (0.55) | ALDH1A1PRSS1PRSS2PRSS3CYSLTR2 | |
| SCHEMBL8147781 | 0.83 | ALDH1A1 (0.50) | CXCR5ALDH1A1PRSS1PRSS2PRSS3 | |
| SCHEMBL9903580 | 0.81 | ALDH1A1 (0.43) | CXCR5ALDH1A1PRSS1PRSS2PRSS3 | |
| SCHEMBL30438055 | 0.81 | ALDH1A1 (0.48) | ALDH1A1PRSS1PRSS2PRSS3CYSLTR2 | |
| SCHEMBL9998672 | 0.81 | ALDH1A1 (0.48) | ALDH1A1PRSS1PRSS2PRSS3CYSLTR2 | |
| SCHEMBL27963993 | 0.79 | KDM4E (0.45) | CXCR5ALDH1A1KDM4ERARBNR1I2 | |
| SCHEMBL27838149 | 0.79 | KDM4E (0.47) | ALDH1A1CYSLTR2CYSLTR1KDM4EHPGD | |
| SCHEMBL671032 | 0.78 | ALDH1A1 (0.55) | ALDH1A1PRSS1PRSS2PRSS3CYSLTR2 |
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-2582701-B1 | D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE | ALTOS THERAPEUTICS LLC (US) | 2016-11-02 | — | — | EP | disclosed |
| EP-2582701-A1 | D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE | Altos Therapeutics, LLC (US) | 2013-04-24 | — | — | EP | disclosed |
| WO-2011160084-A1 | D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE | Altos Therapeutics, LLC (US) | 2011-12-22 | — | — | WO | disclosed |