Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | PRKACG | P22612 | 1/20 | 0.36 |
| ▸ | PRKACB | P22694 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL24440539 | 0.91 | KCNA5 (0.40) | ALDH1A1POLBSMN1; SMN2LMNAGAA | |
| SCHEMBL29674604 | 0.86 | KCNA5 (0.38) | ALDH1A1POLBSMN1; SMN2LMNAGAA | |
| SCHEMBL24439251 | 0.86 | KCNA5 (0.38) | ALDH1A1POLBSMN1; SMN2LMNAGAA | |
| SCHEMBL622734 | 0.83 | ALDH1A1 (0.54) | ALDH1A1POLBLMNAGAANPSR1 | |
| SCHEMBL24438854 | 0.81 | KCNA5 (0.38) | ALDH1A1POLBSMN1; SMN2LMNANPSR1 | |
| SCHEMBL29674713 | 0.81 | KCNA5 (0.38) | ALDH1A1POLBSMN1; SMN2LMNANPSR1 | |
| SCHEMBL29674641 | 0.77 | ALDH1A1 (0.48) | ALDH1A1POLBLMNAGAANPSR1 | |
| SCHEMBL24439233 | 0.77 | ALDH1A1 (0.48) | ALDH1A1POLBLMNAGAANPSR1 | |
| SCHEMBL11148117 | 0.76 | ALDH1A1 (0.52) | ALDH1A1POLBLMNAGAANPSR1 | |
| SCHEMBL13413755 | 0.76 | LMNA (0.36) | ALDH1A1POLBSMN1; SMN2LMNANPSR1 |
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 2 patents. 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 |
| WO-2022103280-A1 | METHANOGEN INHIBITORS | PASTORAL GREENHOUSE GAS RESEARCH LTD (NZ) | 2022-05-19 | — | — | WO | disclosed |