Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 18/20 | 0.57 |
| ▸ | HTR1A | P08908 | 5/20 | 0.50 |
| ▸ | HTR2A | P28223 | 4/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 5/20 | 0.49 |
| ▸ | HTR6 | P50406 | 3/20 | 0.49 |
| ▸ | DRD4 | P21917 | 3/20 | 0.49 |
| ▸ | HTR7 | P34969 | 3/20 | 0.49 |
| ▸ | HTR2B | P41595 | 2/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | MLNR | O43193 | 1/20 | 0.49 |
| ▸ | HTR3B | O95264 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL25003038 | 1.00 | DRD2 (0.57) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL25003002 | 0.91 | DRD2 (0.56) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL25002997 | 0.91 | DRD2 (0.56) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL25003006 | 0.87 | DRD2 (0.65) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL30839773 | 0.87 | DRD2 (0.65) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL30839769 | 0.86 | DRD2 (0.66) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL25003005 | 0.86 | DRD2 (0.66) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL25003024 | 0.85 | DRD2 (0.68) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL25003041 | 0.85 | DRD2 (0.68) | DRD2HTR1AHTR2AKCNH2SLC6A4 | |
| SCHEMBL30839782 | 0.85 | DRD2 (0.68) | DRD2HTR1AHTR2AKCNH2SLC6A4 |
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 |