Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.66 |
| ▸ | S1PR5 | Q9H228 | 9/20 | 0.63 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.57 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29288200 | 0.88 | MAOB (0.67) | MAOBS1PR5HRH3NPC1RAB9A | |
| SCHEMBL3028338 | 0.88 | S1PR5 (0.81) | S1PR5HRH3S1PR1HTR2AKCNH2 | |
| SCHEMBL29288176 | 0.87 | S1PR5 (0.79) | MAOBS1PR5HRH3NPC1RAB9A | |
| SCHEMBL29288192 | 0.87 | MAOB (0.66) | MAOBS1PR5HRH3NPC1RAB9A | |
| SCHEMBL29288182 | 0.87 | MAOB (0.76) | MAOBS1PR5HRH3NPC1RAB9A | |
| SCHEMBL29288173 | 0.81 | S1PR5 (0.81) | MAOBS1PR5NPC1RAB9AS1PR1 | |
| SCHEMBL29288185 | 0.80 | MAOB (1.00) | MAOBS1PR5NPC1RAB9APARP10 | |
| SCHEMBL29288196 | 0.80 | MAOB (0.76) | MAOBS1PR5NPC1RAB9APARP10 | |
| SCHEMBL3034496 | 0.77 | S1PR5 (1.00) | S1PR5HRH3S1PR1HTR2AKCNH2 | |
| SCHEMBL3044025 | 0.76 | S1PR5 (0.82) | S1PR5HRH3S1PR1HTR2AKCNH2 |
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-108912029-B | Nitrogen-containing heterocyclic amide derivative and use thereof | 广东东阳光药业有限公司 | 2021-10-01 | — | — | CN | disclosed |