Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.61 |
| ▸ | DRD2 | P14416 | 4/20 | 0.55 |
| ▸ | DRD3 | P35462 | 3/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
| ▸ | DRD1 | P21728 | 1/20 | 0.55 |
| ▸ | DRD5 | P21918 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 1/20 | 0.55 |
| ▸ | HRH1 | P35367 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.53 |
| ▸ | DRD4 | P21917 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4745671 | 0.87 | PDK1 (0.60) | SIGMAR1HRH3PDK1PDK2BCHE | |
| SCHEMBL4744391 | 0.84 | HRH3 (0.57) | SIGMAR1HRH3PDK1PDK2BCHE | |
| SCHEMBL4742735 | 0.83 | HRH3 (0.61) | SIGMAR1HRH3PDK1PDK2BCHE | |
| SCHEMBL4744065 | 0.83 | HRH3 (0.56) | SIGMAR1HRH3PDK1PDK2BCHE | |
| SCHEMBL4744412 | 0.81 | HRH3 (0.55) | SIGMAR1HRH3PDK1PDK2 | |
| SCHEMBL4745200 | 0.81 | HRH3 (0.55) | SIGMAR1HRH3PDK1PDK2 | |
| SCHEMBL4742556 | 0.80 | HRH3 (0.54) | SIGMAR1HRH3PDK1PDK2BCHE | |
| SCHEMBL4741953 | 0.80 | HRH3 (0.56) | SIGMAR1HRH3 | |
| SCHEMBL4741928 | 0.80 | HRH3 (0.54) | SIGMAR1HRH3PDK1PDK2BCHE | |
| SCHEMBL4745128 | 0.80 | HRH3 (0.54) | SIGMAR1HRH1HRH3PDK1PDK2 |
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 | claimed |