Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | STS | P08842 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 4/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.33 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.33 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 3/20 | 0.33 |
| ▸ | NOS2 | P35228 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6605969 | 1.00 | SLC6A2 (0.37) | SLC6A2SLC6A4SLC6A3STSKCNH2 | |
| SCHEMBL6607474 | 0.85 | KCNA5 (0.39) | STSPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL6605208 | 0.84 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR6RORC | |
| SCHEMBL6605205 | 0.84 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HTR6RORC | |
| SCHEMBL5971586 | 0.82 | REN (0.32) | KCNH2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL3955650 | 0.81 | CTSL (0.36) | SLC6A2SLC6A4SLC6A3STSRORC | |
| SCHEMBL3955653 | 0.81 | CTSL (0.36) | SLC6A2SLC6A4SLC6A3STSRORC | |
| SCHEMBL3955656 | 0.79 | STS (0.35) | SLC6A2SLC6A4SLC6A3STSHTR6 | |
| SCHEMBL6589031 | 0.78 | — | — | |
| SCHEMBL6610801 | 0.71 | MBTPS1 (0.34) | SLC6A2SLC6A4SLC6A3MBTPS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1307204-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2004-06-02 | — | — | EP | disclosed |
| EP-1307204-A1 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2003-05-07 | — | — | EP | disclosed |
| WO-2001095911-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-12-20 | — | — | WO | disclosed |