Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | ACSL1 | P33121 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | GRM6 | O15303 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870715 | 0.94 | TRPA1 (0.40) | ALDH1A1LMNATRPA1ACSL1CYP3A4 | |
| SCHEMBL9870411 | 0.93 | CA12 (0.36) | ALDH1A1MAPTLMNAMAOBACSL1 | |
| SCHEMBL9874547 | 0.92 | TSHR (0.41) | ALDH1A1MAPTLMNATRPA1CYP3A4 | |
| SCHEMBL9869691 | 0.92 | TSHR (0.41) | ALDH1A1MAPTLMNATRPA1CYP3A4 | |
| SCHEMBL9870673 | 0.92 | TSHR (0.41) | ALDH1A1MAPTLMNATRPA1CYP3A4 | |
| SCHEMBL9871350 | 0.89 | TRPA1 (0.40) | ALDH1A1LMNATRPA1CYP1A2CYP3A4 | |
| SCHEMBL9873316 | 0.88 | MAOA (0.35) | ALDH1A1MAPTMAOBTRPA1ACSL1 | |
| SCHEMBL9870495 | 0.86 | TRPA1 (0.38) | ALDH1A1LMNATRPA1ACSL1CYP3A4 | |
| SCHEMBL9778781 | 0.86 | ACSL1 (0.38) | ALDH1A1MAPTLMNAMAOBACSL1 | |
| SCHEMBL9869831 | 0.84 | TRPA1 (0.40) | ALDH1A1LMNATRPA1CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5026492-A | Synergistic; improved wear resistance in internal combustion engines | EXXON RESEARCH & ENGINEERING COMPANY (US) | 1991-06-25 | — | — | US | disclosed |