Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | LAP3 | P28838 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | NEU1 | Q99519 | 1/20 | 0.35 |
| ▸ | NEU2 | Q9Y3R4 | 1/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9708851 | 0.83 | TRPA1 (0.41) | TRPA1CYP3A4MAPK1ANPEPLAP3 | |
| SCHEMBL7277789 | 0.83 | TRPA1 (0.41) | TRPA1CYP3A4MAPK1ANPEPLAP3 | |
| SCHEMBL9708802 | 0.83 | TRPA1 (0.41) | TRPA1CYP3A4MAPK1ANPEPLAP3 | |
| SCHEMBL7300749 | 0.83 | TRPA1 (0.41) | TRPA1CYP3A4MAPK1ANPEPLAP3 | |
| SCHEMBL9701045 | 0.76 | HTT (0.44) | CYP3A4MAPK1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8531796 | 0.76 | LAP3 (0.47) | CYP3A4MAPK1ANPEPLAP3TAAR1 | |
| SCHEMBL8945893 | 0.76 | LAP3 (0.47) | CYP3A4MAPK1ANPEPLAP3TAAR1 | |
| SCHEMBL9699771 | 0.71 | SIGMAR1 (0.37) | TRPA1CYP3A4MAPK1SIGMAR1SLC6A3 | |
| SCHEMBL108646 | 0.71 | TRPA1 (0.58) | TRPA1ANPEPLAP3TAAR1SLC6A2 | |
| SCHEMBL7451566 | 0.70 | HTT (0.58) | MAPK1 |
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-6313177-B1 | AS ANTIVIRAL AGENTS | PHARMACOR INC. (CA) | 2001-11-06 | — | — | US | disclosed |