Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | FABP7 | O15540 | 1/20 | 0.43 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31319088 | 0.79 | MEN1 (0.44) | ALDH1A1ACHECA1CA2MMP2 | |
| SCHEMBL2077752 | 0.76 | ALDH1A1 (0.46) | NPC1RAB9AATMALDH1A1L3MBTL1 | |
| SCHEMBL22028110 | 0.73 | LTA4H (0.58) | NPC1RAB9AATMFABP7FABP5 | |
| SCHEMBL6644102 | 0.73 | LTA4H (0.58) | NPC1RAB9AATMFABP7FABP5 | |
| SCHEMBL22028109 | 0.73 | LTA4H (0.58) | NPC1RAB9AATMFABP7FABP5 | |
| SCHEMBL1521953 | 0.73 | LTA4H (0.58) | NPC1RAB9AATMFABP7FABP5 | |
| SCHEMBL8736574 | 0.72 | ALOX5 (0.58) | NPC1RAB9AATMCHRM5CHRM1 | |
| SCHEMBL6880683 | 0.71 | ALDH1A1 (0.55) | NPC1RAB9AATMALDH1A1L3MBTL1 | |
| SCHEMBL5967202 | 0.71 | KEAP1 (0.51) | NPC1RAB9AATMCHRM5CHRM1 | |
| SCHEMBL15479668 | 0.71 | ALDH1A1 (0.58) | NPC1RAB9AALDH1A1L3MBTL1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117750966-A | Pharmaceutical compositions comprising a panidine receptor modulator and uses thereof | 阿姆果制药有限公司 | 2024-03-22 | — | — | CN | disclosed |
| CN-116887839-A | Crystalline forms of lannodine receptor modulator and uses thereof | 阿姆果制药有限公司 | 2023-10-13 | — | — | CN | disclosed |