Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 2/20 | 0.54 |
| ▸ | IAPP | P10997 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | TERT | O14746 | 1/20 | 0.39 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL22445660 | 0.94 | TBXAS1 (0.59) | TBXAS1IAPPTAAR1HTR1ATERT | |
| Valeric Acid SCHEMBL28634371 | 0.83 | TBXAS1 (0.74) | TBXAS1ALOX15HRH4KMT2A | |
| Acetic Acid SCHEMBL28627407 | 0.80 | TBXAS1 (0.61) | TBXAS1TAAR1HTR1ATERTFDPS | |
| Butyric Acid SCHEMBL27339275 | 0.79 | TBXAS1 (0.69) | TBXAS1TAAR1HTR1ATERTFDPS | |
| Propionic Acid SCHEMBL28634239 | 0.79 | TBXAS1 (0.64) | TBXAS1TAAR1HTR1ATERTFDPS | |
| Acetic Acid SCHEMBL28871346 | 0.79 | TBXAS1 (0.62) | TBXAS1TAAR1HTR1ATERTFDPS | |
| SCHEMBL81566 | 0.79 | — | — | |
| Hexanoate SCHEMBL28631635 | 0.78 | TBXAS1 (0.77) | TBXAS1ALOX15MAPTKMT2A | |
| SCHEMBL18857561 | 0.78 | TBXAS1 (0.48) | TBXAS1TAAR1HTR1ATERTFDPS | |
| SCHEMBL8649840 | 0.78 | TBXAS1 (0.57) | TBXAS1TAAR1HTR1ATERTFDPS |
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-0111384-A1 | Thioketal substituted N-alkyl imidazoles and pharmaceutical compositions containing them | SYNTEX (U.S.A.) INC. (US) | 1984-06-20 | — | — | EP | disclosed |