Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135452 | 0.82 | SLC6A4 (0.47) | SLC6A4PARP1SLC6A2KCNH2SLC6A3 | |
| SCHEMBL5140427 | 0.81 | SLC6A4 (0.38) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL5190868 | 0.75 | SLC6A4 (0.45) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL5146827 | 0.73 | CNR2 (0.41) | SLC6A4PARP1SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL5136170 | 0.72 | SLC6A4 (0.44) | SLC6A4SLC6A2KCNH2SLC6A3CYP2D6 | |
| SCHEMBL5134802 | 0.71 | PARP1 (0.51) | SLC6A4PARP1SLC6A2KCNH2SLC6A3 | |
| SCHEMBL5134122 | 0.70 | PARP1 (0.41) | PARP1KCNH2KMT2AKDM4EPOLB | |
| SCHEMBL19710924 | 0.67 | PDK2 (0.50) | HSD11B1KMT2AMEN1RAB9AKDM4E | |
| SCHEMBL28633494 | 0.66 | SMO (0.53) | SLC6A4SLC6A2SLC6A3KMT2A | |
| SCHEMBL5134854 | 0.65 | CNR1 (0.37) | PARP1KCNH2KMT2AMEN1KDM4E |
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 |