Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24438836 | 1.00 | TDP1 (0.34) | TDP1KCNA5KCNH2CYP1A2CYP3A4 | |
| SCHEMBL24439236 | 0.84 | ALDH1A1 (0.32) | TDP1NPSR1ALDH1A1POLBGAA | |
| SCHEMBL24440539 | 0.82 | KCNA5 (0.40) | TDP1KCNA5KCNH2CYP1A2CYP3A4 | |
| SCHEMBL24438661 | 0.80 | ALDH1A1 (0.41) | CYP1A2CYP2C9NPSR1ALDH1A1POLB | |
| SCHEMBL29674654 | 0.78 | ALDH1A1 (0.50) | NPSR1ALDH1A1POLBGAA | |
| SCHEMBL29674604 | 0.77 | KCNA5 (0.38) | TDP1KCNA5KCNH2CYP1A2CYP3A4 | |
| SCHEMBL24439251 | 0.77 | KCNA5 (0.38) | TDP1KCNA5KCNH2CYP1A2CYP3A4 | |
| SCHEMBL29674592 | 0.77 | PTGS1 (0.33) | ALDH1A1 | |
| SCHEMBL24439231 | 0.76 | ALDH1A1 (0.43) | TDP1CYP1A2NPSR1ALDH1A1POLB | |
| SCHEMBL24438663 | 0.76 | ALDH1A1 (0.43) | TDP1NPSR1ALDH1A1POLBLMNA |
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-2022103280-A1 | METHANOGEN INHIBITORS | PASTORAL GREENHOUSE GAS RESEARCH LTD (NZ) | 2022-05-19 | — | — | WO | disclosed |