Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 19/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5140427 | 0.81 | SLC6A4 (0.38) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL28633494 | 0.75 | SMO (0.53) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL5146827 | 0.72 | CNR2 (0.41) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL5135114 | 0.68 | SLC6A2 (0.53) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL672520 | 0.68 | SLC6A4 (0.72) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL672519 | 0.68 | SLC6A4 (0.72) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL28292429 | 0.67 | MCHR1 (0.60) | — | |
| SCHEMBL5135452 | 0.66 | SLC6A4 (0.47) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL5134802 | 0.66 | PARP1 (0.51) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| Hydrochloric Acid SCHEMBL30272616 | 0.66 | MCHR1 (0.59) | — |
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-1942893-A2 | PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | Merck & Co., Inc. (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007053400-A2 | PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO., INC. (US) | 2007-05-10 | — | — | WO | disclosed |