Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8015260 | 1.00 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3CYP1A2KMT2A | |
| SCHEMBL8015254 | 1.00 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3CYP1A2KMT2A | |
| SCHEMBL8015266 | 1.00 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3CYP1A2KMT2A | |
| SCHEMBL4803479 | 0.96 | CYP3A4 (0.39) | SLC6A2SLC6A4SLC6A3KMT2AMAOA | |
| SCHEMBL4803508 | 0.96 | CYP3A4 (0.39) | SLC6A2SLC6A4SLC6A3KMT2AMAOA | |
| SCHEMBL8771230 | 0.96 | CYP3A4 (0.39) | SLC6A2SLC6A4SLC6A3KMT2AMAOA | |
| SCHEMBL4803500 | 0.96 | CYP3A4 (0.39) | SLC6A2SLC6A4SLC6A3KMT2AMAOA | |
| SCHEMBL7757091 | 0.96 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3CYP1A2KMT2A | |
| SCHEMBL7757090 | 0.96 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3CYP1A2KMT2A | |
| SCHEMBL10479748 | 0.94 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3CYP1A2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0799878-A1 | Liquid crystal compositions and liquid crystal display elements containing same | Shin-Etsu Chemical Co., Ltd. (JP) | 1997-10-08 | — | — | EP | disclosed |