Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 9/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL7463737 | 0.96 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3ATMHTT | |
| SCHEMBL6152014 | 0.80 | SLC6A4 (0.58) | SLC6A2SLC6A4SLC6A3HRH3 | |
| SCHEMBL6151885 | 0.79 | SLC6A4 (0.57) | SLC6A2SLC6A4SLC6A3ATMHTT | |
| SCHEMBL6431344 | 0.79 | SLC6A2 (0.65) | SLC6A2SLC6A4SLC6A3ALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL6151478 | 0.79 | SLC6A4 (0.56) | SLC6A2SLC6A4SLC6A3ATMHTT | |
| SCHEMBL6151499 | 0.77 | SLC6A4 (0.57) | SLC6A2SLC6A4SLC6A3HRH3 | |
| SCHEMBL6151526 | 0.77 | SLC6A4 (0.45) | SLC6A2SLC6A4SLC6A3ATMNPSR1 | |
| Hydrochloric Acid SCHEMBL7107764 | 0.76 | SLC6A4 (0.56) | SLC6A2SLC6A4SLC6A3HRH3 | |
| SCHEMBL7457814 | 0.76 | SLC6A4 (0.42) | SLC6A2SLC6A4SLC6A3ATMHTT | |
| SCHEMBL7457810 | 0.74 | ATM (0.41) | SLC6A2SLC6A4SLC6A3ATMHTT |
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-1220831-A1 | BIARYL ETHER DERIVATIVES USEFUL AS MONOAMINE REUPTAKE INHIBITORS | Pfizer Products Inc. (US) | 2002-07-10 | — | — | EP | disclosed |
| WO-2001027068-A1 | BIARYL ETHER DERIVATIVES USEFUL AS MONOAMINE REUPTAKE INHIBITORS | PFIZER PRODUCTS INC. (US) | 2001-04-19 | — | — | WO | disclosed |