Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | PTAFR | P25105 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18287910 | 0.78 | MAOA (0.50) | ACHECA9ALDH1A1MEN1KMT2A | |
| SCHEMBL9337958 | 0.75 | MAPT (0.40) | ACHEMAPTCYP3A4CA9PTAFR | |
| SCHEMBL8563574 | 0.74 | MAPT (0.44) | ACHEMAPTCYP3A4CA9PTAFR | |
| SCHEMBL18287909 | 0.72 | MAOA (0.47) | ACHECA9ALDH1A1MEN1KMT2A | |
| SCHEMBL9729169 | 0.71 | ALDH1A1 (0.36) | MAPTCYP3A4CA9PTAFRPTGS2 | |
| SCHEMBL9338353 | 0.71 | L3MBTL1 (0.37) | ACHEMAPTCA9PTAFRKDM4E | |
| SCHEMBL28893222 | 0.69 | MAPT (0.54) | ACHEMAPTCYP3A4CA9PTAFR | |
| SCHEMBL9719037 | 0.69 | MAPT (0.54) | ACHEMAPTCYP3A4CA9PTAFR | |
| SCHEMBL9338356 | 0.69 | KDM4E (0.37) | ACHEMAPTCYP3A4CA9PTAFR | |
| SCHEMBL9721261 | 0.68 | LMNA (0.41) | ACHEMAPTCYP3A4CA9PTAFR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003082199-A2 | PLATELET-ACTIVATING FACTOR ANTAGONISTS AS ANALGESIC, ANTI-INFLAMMATORY, UTERINE CONTRACTION INHIBITING, AND ANTI-TUMOR AGENTS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2003-10-09 | — | — | WO | claimed |