Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | SCN4A | P35499 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20134752 | 0.81 | ADAM17 (0.45) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL4232196 | 0.81 | CYP2C9 (0.55) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20134939 | 0.76 | AKR1B1 (0.40) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20134941 | 0.76 | AKR1B1 (0.40) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20135355 | 0.75 | AKR1B1 (0.36) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20135356 | 0.75 | AKR1B1 (0.36) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20134891 | 0.71 | MMP14 (0.40) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL542293 | 0.69 | AKR1B10 (0.39) | MAPTAKR1B1GAALMNA | |
| SCHEMBL11010656 | 0.68 | CYP2C9 (0.47) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20135629 | 0.67 | AKR1B1 (0.35) | CYP2C9CACNA1FALDH1A1MAPTHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3321256-A1 | NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE | Mitsubishi Tanabe Pharma Corporation (JP) | 2018-05-16 | — | — | EP | disclosed |