Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 18/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 13/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5136170 | 0.83 | SLC6A4 (0.44) | SLC6A4SLC6A2SLC6A3CYP2D6HSD11B1 | |
| SCHEMBL5135452 | 0.83 | SLC6A4 (0.47) | SLC6A4SLC6A2SLC6A3CYP2D6HSD11B1 | |
| SCHEMBL5134527 | 0.75 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3CYP2D6HSD11B1 | |
| SCHEMBL5140427 | 0.74 | SLC6A4 (0.38) | SLC6A4SLC6A2SLC6A3CYP2D6HSD11B1 | |
| SCHEMBL16099881 | 0.69 | HSD11B1 (0.53) | SLC6A4SLC6A2SLC6A3HSD11B1KCNH2 | |
| SCHEMBL23228615 | 0.67 | SLC6A4 (0.51) | SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL10107580 | 0.66 | SLC6A4 (0.64) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL12209651 | 0.66 | HTR2C (0.45) | HSD11B1 | |
| SCHEMBL3969439 | 0.66 | HTR2C (0.53) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL4291607 | 0.65 | SLC6A4 (0.50) | SLC6A4SLC6A2SLC6A3KCNH2 |
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 |