Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 12/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.49 |
| ▸ | HTR3B | O95264 | 3/20 | 0.49 |
| ▸ | HTR3A | P46098 | 3/20 | 0.49 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.49 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29676235 | 1.00 | ACACB (0.50) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL29675364 | 0.86 | HTR3E (0.46) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL18765485 | 0.86 | HTR3E (0.46) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL29676274 | 0.84 | HTR3E (0.46) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL29675721 | 0.82 | PIM2 (0.45) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL29675686 | 0.82 | PIM2 (0.45) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL8274290 | 0.78 | HTR3A (0.62) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL31592602 | 0.77 | MAPK1 (0.64) | MAPK1 | |
| SCHEMBL18793898 | 0.77 | MAPK1 (0.47) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL24925881 | 0.76 | HTR3A (0.61) | HTR3EHTR3BHTR3AHTR3DHTR3C |
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-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |