Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.71 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.71 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.71 |
| ▸ | DHFR | P00374 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL14453326 | 1.00 | SLC6A3 (0.71) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL13060552 | 1.00 | SLC6A3 (0.71) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL26840808 | 1.00 | SLC6A3 (0.71) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL14602065 | 1.00 | SLC6A3 (0.71) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL26720835 | 1.00 | SLC6A3 (0.71) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL23459443 | 0.95 | SLC6A3 (0.63) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL19574769 | 0.95 | SLC6A3 (0.63) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL26720612 | 0.89 | SLC6A3 (0.54) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL10326815 | 0.85 | SLC6A3 (0.59) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL729266 | 0.85 | SLC6A3 (0.59) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7164025-B2 | Manufacture of single isomer methylphenidate | CELLTECH PHARMA EUROPE LIMITED (GB) | 2007-01-16 | — | — | US | disclosed |