Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 13/20 | 0.66 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 4/20 | 0.52 |
| ▸ | DRD4 | P21917 | 3/20 | 0.52 |
| ▸ | HTR1A | P08908 | 3/20 | 0.51 |
| ▸ | HTR7 | P34969 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MLNR | O43193 | 1/20 | 0.50 |
| ▸ | HTR3B | O95264 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL25003005 | 1.00 | DRD2 (0.66) | DRD2MAPTALDH1A1LMNAHPGD | |
| SCHEMBL25003041 | 0.94 | DRD2 (0.68) | DRD2MAPTDRD3DRD4HTR1A | |
| SCHEMBL25003044 | 0.92 | DRD2 (0.58) | DRD2MAPTDRD3DRD4HTR1A | |
| SCHEMBL25003006 | 0.90 | DRD2 (0.65) | DRD2MAPTDRD3DRD4HTR1A | |
| SCHEMBL30839773 | 0.90 | DRD2 (0.65) | DRD2MAPTDRD3DRD4HTR1A | |
| SCHEMBL25004001 | 0.89 | DRD2 (0.67) | DRD2MAPTALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL25003048 | 0.88 | DRD2 (0.56) | DRD2MAPTDRD3DRD4HTR1A | |
| SCHEMBL25004008 | 0.87 | DRD2 (0.67) | DRD2MAPTDRD3DRD4HTR1A | |
| SCHEMBL25004000 | 0.87 | DRD2 (0.63) | DRD2DRD3DRD4HTR1AHTR7 | |
| SCHEMBL25003024 | 0.86 | DRD2 (0.68) | DRD2MAPTDRD3DRD4HTR1A |
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-117769545-A | Tri-fused ring derivative-containing regulator, preparation method and application thereof | 上海枢境生物科技有限公司 | 2024-03-26 | — | — | CN | disclosed |