Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | DRD5 | P21918 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24460737 | 1.00 | ALDH1A1 (0.48) | ALDH1A1CNR2DRD2DRD4DRD1 | |
| SCHEMBL24460758 | 0.89 | ALDH1A1 (0.59) | ALDH1A1CNR2DRD2DRD4DRD1 | |
| SCHEMBL24460679 | 0.87 | DRD4 (0.52) | ALDH1A1CNR2DRD2DRD4DRD1 | |
| SCHEMBL24460772 | 0.84 | ALDH1A1 (0.53) | ALDH1A1CNR2DRD2DRD4DRD1 | |
| SCHEMBL24460672 | 0.83 | CNR2 (0.48) | ALDH1A1CNR2DRD2DRD4DRD1 | |
| SCHEMBL24460624 | 0.76 | GAA (0.58) | ALDH1A1CNR2DRD2DRD4DRD1 | |
| SCHEMBL9660685 | 0.75 | DRD2 (0.50) | DRD2DRD4DRD1DRD5DRD3 | |
| SCHEMBL1165030 | 0.74 | HRH3 (0.65) | ALDH1A1HRH3CYP2D6CYP2C19 | |
| SCHEMBL21094080 | 0.72 | HRH3 (0.69) | ALDH1A1HRH3CYP2D6CYP2C19 | |
| SCHEMBL13293909 | 0.72 | HRH3 (0.69) | ALDH1A1HRH3CYP2D6CYP2C19 |
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-2022109209-A1 | SMALL MOLECULE COMPOUNDS AND COMPOSITIONS | TELO THERAPEUTICS, INC. (US) | 2022-05-27 | — | — | WO | disclosed |