Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 9/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10778228 | 0.85 | SLC6A4 (0.44) | SLC6A2SLC6A4SLC6A3KCNH2RAB9A | |
| SCHEMBL28573859 | 0.83 | SLC6A4 (0.36) | SLC6A2SLC6A4SLC6A3KCNH2RAB9A | |
| SCHEMBL28351516 | 0.79 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3KCNH2RAB9A | |
| SCHEMBL22500142 | 0.76 | ESR2 (0.53) | SLC6A2SLC6A4SLC6A3KCNH2CYP1A2 | |
| SCHEMBL11096853 | 0.75 | SLC6A4 (0.37) | SLC6A2SLC6A4SLC6A3KCNH2RAB9A | |
| SCHEMBL8172658 | 0.75 | SLC6A2 (0.33) | SLC6A2SLC6A4SLC6A3KCNH2KMT2A | |
| SCHEMBL8168816 | 0.74 | SLC6A2 (0.31) | SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL28026472 | 0.74 | ESR2 (0.52) | SLC6A2SLC6A4SLC6A3KCNH2CYP1A2 | |
| Acetic Acid SCHEMBL13735750 | 0.72 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL27869454 | 0.72 | SLC6A4 (0.43) | SLC6A2SLC6A4SLC6A3KCNH2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-6015508-A | USEFUL FOR ELECTROOPTICAL LIQUID CRYSTAL DISPLAY MATERIALS | CHISSO CORPORATION (JP) | 2000-01-18 | — | — | US | disclosed |
| EP-0861828-A1 | Liquid crystalline compounds containing hydrocarbon groups, liquid crystalline compositions and liquid crystal display elements | Chisso Corporation (JP) | 1998-09-02 | — | — | EP | disclosed |