Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11638197 | 0.90 | AOC3 (0.48) | AOC3HTTMAPTCYP3A4LMNA | |
| SCHEMBL6024638 | 0.89 | POLB (0.47) | AOC3MAPTHTR2AHRH1POLB | |
| SCHEMBL11259100 | 0.85 | TACR3 (0.43) | HTR2APOLBALDH1A1TACR3 | |
| SCHEMBL172612 | 0.85 | LMNA (0.46) | AOC3LMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL13302608 | 0.85 | LMNA (0.46) | AOC3LMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL12312555 | 0.85 | LMNA (0.46) | AOC3LMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL12871175 | 0.82 | TRPA1 (0.50) | HTTCYP3A4LMNACHRM2HTR1A | |
| SCHEMBL13075028 | 0.79 | ALDH1A1 (0.49) | AOC3HTTMAPTCYP3A4LMNA | |
| SCHEMBL172587 | 0.79 | ALDH1A1 (0.49) | AOC3HTTMAPTCYP3A4LMNA | |
| SCHEMBL172552 | 0.79 | ALDH1A1 (0.49) | AOC3HTTMAPTCYP3A4LMNA |
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-5439251-A | Less toxic; easy to handle | TOYO KASEI KOGYO COMPANY LIMITED (JP) | 1995-08-08 | — | — | US | disclosed |