Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYK2 | P29597 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL19566796 | 0.79 | OPRM1 (0.33) | OPRM1OPRD1OPRK1 | |
| SCHEMBL20781997 | 0.76 | OPRM1 (0.32) | OPRM1OPRD1OPRK1 | |
| SCHEMBL26017859 | 0.75 | OPRM1 (0.31) | OPRM1OPRD1OPRK1 | |
| SCHEMBL24093353 | 0.71 | KDM4E (0.54) | OPRM1 | |
| SCHEMBL19567668 | 0.71 | NPC1 (0.43) | — | |
| SCHEMBL2398384 | 0.70 | OPRM1 (0.31) | OPRM1OPRD1OPRK1 | |
| SCHEMBL2397427 | 0.70 | ALDH1A1 (0.40) | OPRM1OPRD1OPRK1 | |
| SCHEMBL19567195 | 0.70 | ALDH1A1 (0.53) | — | |
| Hydrochloric Acid SCHEMBL2400134 | 0.69 | OPRM1 (0.33) | OPRM1OPRD1OPRK1 | |
| SCHEMBL19567495 | 0.69 | USP2 (0.38) | TYK2OPRM1 |
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-3452464-B1 | PYRAZOLE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USE THEREOF | HOFFMANN LA ROCHE (CH) | 2021-12-15 | — | — | EP | disclosed |
| WO-2017191098-A1 | PYRAZOLE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2017-11-09 | — | — | WO | disclosed |