Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 5/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 2/20 | 0.38 |
| ▸ | SMARCA4 | P51532 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23301408 | 1.00 | TMEM97 (0.39) | TMEM97SIGMAR1AURKARPS6KB1CHRM4 | |
| SCHEMBL29910604 | 0.94 | CHRM4 (0.40) | TMEM97SIGMAR1AURKARPS6KB1CHRM4 | |
| SCHEMBL23302343 | 0.94 | CHRM4 (0.40) | TMEM97SIGMAR1AURKARPS6KB1CHRM4 | |
| SCHEMBL23304195 | 0.93 | LTA4H (0.41) | TMEM97SIGMAR1KDM4EHTTKMT2A | |
| SCHEMBL29910652 | 0.93 | LTA4H (0.41) | TMEM97SIGMAR1KDM4EHTTKMT2A | |
| SCHEMBL29838301 | 0.90 | SMARCA2 (0.50) | TMEM97SIGMAR1SMARCA2SMARCA4CYP2C19 | |
| SCHEMBL21405369 | 0.90 | SMARCA2 (0.50) | TMEM97SIGMAR1SMARCA2SMARCA4CYP2C19 | |
| SCHEMBL23301482 | 0.89 | SMARCA2 (0.52) | TMEM97SIGMAR1AURKARPS6KB1SMARCA2 | |
| SCHEMBL29910770 | 0.89 | SMARCA2 (0.52) | TMEM97SIGMAR1AURKARPS6KB1SMARCA2 | |
| SCHEMBL23301307 | 0.89 | OPRM1 (0.43) | TMEM97SIGMAR1CHRM4SMARCA2SMARCA4 |
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 |