Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | TTK | P33981 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.33 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | APLNR | P35414 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25650131 | 0.81 | STING1 (0.34) | TRPA1KMT2AALDH1A1ATML3MBTL1 | |
| SCHEMBL31038852 | 0.81 | LOXL2 (0.41) | TRPA1AURKATTKAURKBINCENP | |
| SCHEMBL31214403 | 0.79 | MAPK1 (0.39) | TRPA1KMT2AALDH1A1L3MBTL1AURKA | |
| SCHEMBL31151108 | 0.79 | NOS2 (0.40) | ALDH1A1AURKATTKAURKBINCENP | |
| SCHEMBL27047601 | 0.79 | PDCD1 (0.35) | TRPA1KMT2AALDH1A1AURKATTK | |
| SCHEMBL4405916 | 0.78 | AURKA (0.33) | AURKATTKAURKBINCENPAPLNR | |
| SCHEMBL27882381 | 0.76 | TRPA1 (0.39) | TRPA1KMT2AALDH1A1AURKATTK | |
| SCHEMBL29517451 | 0.76 | TRPA1 (0.39) | TRPA1KMT2AALDH1A1AURKATTK | |
| SCHEMBL21598410 | 0.75 | CCR4 (0.37) | TRPA1KMT2AL3MBTL1AURKATTK | |
| SCHEMBL25270718 | 0.74 | LRRK2 (0.33) | TRPA1KMT2AALDH1A1ATML3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118359638-A | Compound serving as RET kinase inhibitor and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-07-19 | — | — | CN | disclosed |