Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | HPGDS | O60760 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 3/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.33 |
| ▸ | PLAT | P00750 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18814355 | 0.82 | HTR2C (0.37) | SLC18A3SIGMAR1HRH3ADORA2AADORA2B | |
| Hydrochloric Acid SCHEMBL2902954 | 0.81 | HTR2C (0.39) | HRH3ADORA2AADORA2BHPGDSMEN1 | |
| SCHEMBL28239703 | 0.79 | ADORA2A (0.33) | SLC18A3SIGMAR1HRH3ADORA2AADORA2B | |
| SCHEMBL27323115 | 0.78 | CACNA1H (0.40) | HRH3HRH4 | |
| SCHEMBL25934002 | 0.78 | HTR2C (0.41) | HPGDSMEN1KMT2APARP1MAPK13 | |
| SCHEMBL13572996 | 0.77 | KDM4E (0.45) | ADORA2AADORA2BMEN1KMT2AMAPT | |
| SCHEMBL16823987 | 0.74 | KHK (0.34) | HRH3KMT2APARP1 | |
| SCHEMBL2755244 | 0.73 | HPGDS (0.40) | SLC18A3SIGMAR1HPGDSPARP1MAPK13 | |
| SCHEMBL3941345 | 0.73 | HPGDS (0.50) | SLC18A3SIGMAR1HPGDSHTR2CPLAT | |
| Hydrochloric Acid SCHEMBL239078 | 0.72 | HPGDS (0.40) | SLC18A3SIGMAR1HPGDSPARP1MAPK13 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023144160-A1 | NEW HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-08-03 | — | — | WO | disclosed |