Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 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 | |
|---|---|---|---|---|
| SCHEMBL8284261 | 0.81 | ADRA2A (0.37) | CYP2C19CYP2D6TRPA1LMNACYP1A2 | |
| SCHEMBL8286102 | 0.81 | ESR1 (0.43) | CYP2D6CYP3A4TSHRSLC6A2ACHE | |
| SCHEMBL9482716 | 0.79 | ALDH1A1 (0.54) | ALDH1A1CYP2C19TRPA1LMNATAAR1 | |
| SCHEMBL24222490 | 0.79 | ADRB1 (0.36) | CYP2C19CYP2D6MAPK1ADRB1ADRA2A | |
| SCHEMBL771406 | 0.76 | TSHR (0.59) | ALDH1A1CYP2C19TRPA1LMNATAAR1 | |
| SCHEMBL8285919 | 0.75 | CA1 (0.37) | ALDH1A1CYP2D6LMNACYP1A2CYP3A4 | |
| SCHEMBL9460757 | 0.74 | ALDH1A1 (0.48) | ALDH1A1CYP2C19CYP2D6TRPA1LMNA | |
| SCHEMBL8997134 | 0.73 | ALDH1A1 (0.46) | ALDH1A1CYP2C19TRPA1LMNATAAR1 | |
| SCHEMBL9495194 | 0.72 | ALDH1A1 (0.56) | ALDH1A1CYP2C19TRPA1LMNATAAR1 | |
| SCHEMBL5595989 | 0.72 | ALDH1A1 (0.56) | ALDH1A1CYP2C19TRPA1LMNATAAR1 |
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-2021253091-A1 | COMPOUNDS FOR AND METHODS OF TREATING DISEASES | Alterity Therapeutics Limited (AU) | 2021-12-23 | — | — | WO | disclosed |