Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7778838 | 0.92 | SLC6A3 (0.39) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL7778833 | 0.92 | SLC6A3 (0.39) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL8997302 | 0.90 | MAPK1 (0.41) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL8997283 | 0.89 | GRM2 (0.43) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL10634647 | 0.85 | SLC6A3 (0.41) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL10634635 | 0.85 | SLC6A3 (0.41) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL17355533 | 0.84 | CYP3A4 (0.37) | SLC6A3KDM1ARCOR1TAAR1CYP2C9 | |
| SCHEMBL13381355 | 0.84 | ALDH1A1 (0.34) | SLC6A3MAPK1GRM2CYP2C9SLC6A2 | |
| SCHEMBL7778853 | 0.84 | MAPK1 (0.37) | SLC6A3MAPK1DRD2KDM1ARCOR1 | |
| SCHEMBL7778850 | 0.84 | MAPK1 (0.37) | SLC6A3MAPK1DRD2KDM1ARCOR1 |
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-0471831-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 1996-08-14 | — | — | EP | disclosed |
| US-5389289-A | Chemical and heat resistance | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1995-02-14 | — | — | US | disclosed |