Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Detomidine SCHEMBL247340 | 0.90 | ALDH1A1 (0.35) | TAAR1SLC6A2SLC6A4SLC6A3P2RX7 | |
| Detomidine SCHEMBL7087060 | 0.90 | ALDH1A1 (0.35) | TAAR1SLC6A2SLC6A4SLC6A3P2RX7 | |
| SCHEMBL2102247 | 0.89 | TAAR1 (0.41) | TAAR1HTR1ACYP1A2CYP3A4CYP2D6 | |
| Detomidine SCHEMBL28676651 | 0.89 | ALDH1A1 (0.34) | TAAR1SLC6A2SLC6A4SLC6A3P2RX7 | |
| Detomidine SCHEMBL203174 | 0.89 | ALDH1A1 (0.34) | TAAR1SLC6A2SLC6A4SLC6A3P2RX7 | |
| Detomidine SCHEMBL20362222 | 0.89 | ALDH1A1 (0.34) | TAAR1SLC6A2SLC6A4SLC6A3P2RX7 | |
| Detomidine SCHEMBL21618409 | 0.89 | ALDH1A1 (0.34) | TAAR1SLC6A2SLC6A4SLC6A3P2RX7 | |
| SCHEMBL2102304 | 0.89 | TAAR1 (0.49) | TAAR1HTR1AKCNH2SCN5A | |
| Detomidine SCHEMBL21624996 | 0.87 | SLC6A2 (0.33) | TAAR1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Detomidine SCHEMBL20362216 | 0.85 | ESR1 (0.33) | SLC6A2SLC6A4SLC6A3P2RX7ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1981880-A2 | USE OF 4-IMIDAZOLE DERIVATIVES FOR CNS DISORDERS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007085556-A2 | USE OF 4-IMIDAZOLE DERIVATIVES FOR CNS DISORDERS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-08-02 | — | — | WO | disclosed |