Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 4/20 | 0.49 |
| ▸ | MAOB | P27338 | 4/20 | 0.49 |
| ▸ | PRKCI | P41743 | 1/20 | 0.47 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 3/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6405990 | 0.96 | MAPT (0.58) | MAPTDRD2DRD4MAOAMAOB | |
| SCHEMBL29946465 | 0.96 | MAPT (0.58) | MAPTDRD2DRD4MAOAMAOB | |
| SCHEMBL426336 | 0.89 | NPC1 (0.55) | MAPTDRD2DRD4MAOAMAOB | |
| SCHEMBL4462879 | 0.82 | MAPT (0.58) | MAPTMAOAMAOBPRKCIKIF11 | |
| Phenol SCHEMBL6582797 | 0.81 | NPC1 (0.56) | MAPTDRD2DRD4MAOAMAOB | |
| 4-Aminophenol SCHEMBL7014541 | 0.80 | CA9 (0.57) | MAPTDRD2DRD4MAOAMAOB | |
| SCHEMBL19391 | 0.79 | AHR (0.67) | DRD2DRD4MAOAMAOBAHR | |
| SCHEMBL4891129 | 0.79 | IDO1 (0.54) | MAPTMAOAMAOBKIF11AHR | |
| SCHEMBL7492910 | 0.79 | AHR (0.66) | MAPTDRD4MAOAMAOBKIF11 | |
| SCHEMBL10274553 | 0.79 | MAPT (0.53) | MAPTKIF11NPC1MAPK13MAPK12 |
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-109988093-B | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2023-04-07 | — | — | CN | disclosed |