Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.34 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL1151364 | 0.81 | PNMT (0.60) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL3781759 | 0.81 | GABRA1 (0.46) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL16951603 | 0.79 | SLC6A4 (0.38) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL10656138 | 0.79 | IDO1 (0.48) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL29783268 | 0.79 | PNMT (0.37) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL1150524 | 0.79 | PNMT (0.37) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL1438163 | 0.79 | PDCD1 (0.44) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL13929779 | 0.79 | PNMT (0.37) | PNMTTAAR1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL29668555 | 0.78 | ESR1 (0.44) | TAAR1CYP1A2CYP2A6MAPTTSHR | |
| SCHEMBL608412 | 0.78 | ESR1 (0.44) | TAAR1CYP1A2CYP2A6MAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0550574-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1993-07-14 | — | — | EP | disclosed |
| WO-1992005180-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1992-04-02 | — | — | WO | disclosed |