Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 6/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 2/20 | 0.30 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.30 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.30 |
| ▸ | REN | P00797 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135172 | 0.76 | OPRM1 (0.37) | OPRL1 | |
| SCHEMBL5332677 | 0.73 | OPRL1 (0.33) | OPRL1 | |
| SCHEMBL5135169 | 0.70 | PARP1 (0.39) | OPRL1 | |
| SCHEMBL5134530 | 0.66 | PARP1 (0.33) | OPRL1BTK | |
| SCHEMBL5332667 | 0.62 | — | — | |
| SCHEMBL3694281 | 0.61 | CA1 (0.43) | — | |
| SCHEMBL5134854 | 0.61 | CNR1 (0.37) | OPRL1BACE1 | |
| SCHEMBL5190879 | 0.60 | IRAK4 (0.36) | BTKNPC1RAB9A | |
| SCHEMBL5134806 | 0.59 | PARP2 (0.39) | BTKACVR1 | |
| SCHEMBL24484243 | 0.59 | MEN1 (0.31) | — |
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 |