Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | F10 | P00742 | 5/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.41 |
| ▸ | CACNA1I | Q9P0X4 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | GPR6 | P46095 | 1/20 | 0.40 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.40 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29280947 | 0.93 | F10 (0.45) | GSK3BF10DRD2DRD4 | |
| Trifluoroacetic Acid SCHEMBL29280931 | 0.93 | GSK3B (0.42) | GSK3BF10DRD2DRD4CACNA1I | |
| Trifluoroacetic Acid SCHEMBL29280892 | 0.93 | KDM4E (0.43) | GSK3BDRD2DRD4HTR4KCNH2 | |
| Trifluoroacetic Acid SCHEMBL29280873 | 0.90 | GPR6 (0.46) | F10GPR6 | |
| SCHEMBL30839993 | 0.88 | DRD2 (0.48) | GSK3BDRD2DRD4GPR6 | |
| SCHEMBL29280895 | 0.86 | PDE6D (0.45) | GSK3BF10DRD2DRD4HTR4 | |
| SCHEMBL30843801 | 0.86 | PDE6D (0.45) | GSK3BF10DRD2DRD4HTR4 | |
| Trifluoroacetic Acid SCHEMBL29280904 | 0.85 | GSK3B (0.45) | GSK3BDRD2DRD4HTR4KCNH2 | |
| Trifluoroacetic Acid SCHEMBL29280926 | 0.81 | KDM4E (0.45) | GSK3BHTR4CACNA1IKCNH2CHRM4 | |
| SCHEMBL29280908 | 0.81 | HTR7 (0.47) | GSK3BDRD2DRD4HTR4CACNA1I |
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-117820199-A | Amide compound and application thereof in preparation of Sigma2 and 5HT2A inhibitors | 瀚远医药有限公司 | 2024-04-05 | — | — | CN | disclosed |