Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 7/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10993415 | 0.86 | SLC6A4 (0.42) | SLC6A4HRH3UTS2RSLC6A2SLC6A3 | |
| SCHEMBL10990324 | 0.86 | SLC6A4 (0.42) | SLC6A4HRH3UTS2RSLC6A2SLC6A3 | |
| SCHEMBL10986747 | 0.85 | SLC6A4 (0.43) | SLC6A4HRH3UTS2RSLC6A2SLC6A3 | |
| SCHEMBL10985109 | 0.85 | HRH3 (0.39) | SLC6A4HRH3SLC6A2 | |
| SCHEMBL10990964 | 0.85 | ESR1 (0.38) | SLC6A4HRH3CYP3A4 | |
| SCHEMBL10984411 | 0.85 | SLC6A4 (0.43) | SLC6A4HRH3SLC6A3 | |
| SCHEMBL10984555 | 0.84 | SLC6A4 (0.45) | SLC6A4HRH3SLC6A2SLC6A3CYP1A2 | |
| SCHEMBL10991955 | 0.83 | KDM4E (0.48) | SLC6A4HRH3SLC6A2SLC6A3 | |
| SCHEMBL10991354 | 0.82 | SLC6A4 (0.45) | SLC6A4HRH3SLC6A2SLC6A3 | |
| SCHEMBL10995588 | 0.82 | TMEM97 (0.43) | SLC6A4SIGMAR1SLC6A2SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4500541-A | Pharmacologically active cyclopropane derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-02-19 | — | — | US | disclosed |
| EP-0039771-B1 | CYCLOPROPANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PRODUCTION | MERCK PATENT GmbH (DE) | 1983-10-19 | — | — | EP | disclosed |
| EP-0039771-A1 | Cyclopropane derivatives, pharmaceutical compositions containing them and processes for their production | MERCK PATENT GmbH (DE) | 1981-11-18 | — | — | EP | disclosed |