Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | FNTA | P49354 | 2/20 | 0.38 |
| ▸ | FNTB | P49356 | 2/20 | 0.38 |
| ▸ | PGGT1B | P53609 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 2/20 | 0.38 |
| ▸ | SMARCA4 | P51532 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30796426 | 1.00 | OPRM1 (0.43) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL23301307 | 1.00 | OPRM1 (0.43) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL29942615 | 0.91 | CHRM4 (0.42) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL29910593 | 0.89 | SMARCA2 (0.46) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL23301401 | 0.89 | SMARCA2 (0.46) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL23301408 | 0.89 | TMEM97 (0.39) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL29910559 | 0.89 | TMEM97 (0.39) | OPRM1CHRM4SMN1; SMN2CYP2C19TMEM97 | |
| SCHEMBL23301459 | 0.89 | SMARCA2 (0.53) | OPRM1SMARCA2SMARCA4 | |
| SCHEMBL30797027 | 0.89 | SMARCA2 (0.53) | OPRM1SMARCA2SMARCA4 | |
| SCHEMBL29943157 | 0.89 | SMARCA2 (0.53) | OPRM1SMARCA2SMARCA4 |
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-4054724-A1 | BIFUNCTIONAL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2022-09-14 | — | — | EP | disclosed |
| EP-4051674-A1 | BIFUNCTIONAL COMPOUNDS FOR THE TREATMENT OF CANCER | F. Hoffmann-La Roche AG (CH) | 2022-09-07 | — | — | EP | disclosed |