Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 7/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | AMPD2 | Q01433 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 3/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20653758 | 0.78 | OPRM1 (0.54) | OPRM1OPRL1MCHR1 | |
| SCHEMBL23316767 | 0.69 | OPRL1 (0.50) | OPRM1OPRL1MCHR1 | |
| SCHEMBL20653756 | 0.66 | OPRL1 (0.50) | OPRM1OPRL1 | |
| SCHEMBL23316769 | 0.66 | OPRL1 (0.53) | OPRM1OPRL1 | |
| SCHEMBL22538533 | 0.64 | OPRL1 (0.55) | OPRM1OPRL1AMPD2HDAC3HDAC1 | |
| SCHEMBL20647583 | 0.61 | OPRL1 (0.69) | OPRM1OPRL1 | |
| SCHEMBL20640157 | 0.61 | OPRL1 (0.69) | OPRM1OPRL1 | |
| SCHEMBL18819873 | 0.58 | MEN1 (0.37) | — | |
| SCHEMBL30489408 | 0.58 | KMT2A (0.57) | OPRM1SCN9A | |
| SCHEMBL14894684 | 0.58 | HDAC3 (0.40) | OPRL1AMPD2HDAC3HDAC1HDAC2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019012037-A1 | 1,3-DIAZA-SPIRO-[3.4]-OCTANE DERIVATIVES | Grünenthal GmbH (DE) | 2019-01-17 | — | — | WO | disclosed |