Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4745735 | 0.85 | HRH3 (0.46) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4744495 | 0.82 | HRH3 (0.51) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4745752 | 0.81 | HRH3 (0.52) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4745204 | 0.80 | HRH3 (0.48) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4746343 | 0.77 | HRH3 (0.40) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4744473 | 0.77 | HRH3 (0.50) | HRH3PDK1PDK2SIGMAR1 | |
| SCHEMBL4742019 | 0.74 | HRH3 (0.49) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4746388 | 0.74 | HRH3 (0.54) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4742644 | 0.74 | HRH3 (0.52) | HRH3BCHEACHEPDK1PDK2 | |
| SCHEMBL4745671 | 0.74 | PDK1 (0.60) | HRH3BCHEACHEPDK1PDK2 |
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-2008107321-A1 | HETEROCYCLIC COMPOUNDS USED AS ANTI-NEOPLASIC AGENTS OR CELL PROLIFERATION INHIBITORS | CEREP (FR) | 2008-09-12 | — | — | WO | disclosed |