Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
| ▸ | SCN1A | P35498 | 1/20 | 0.53 |
| ▸ | SCN4A | P35499 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.53 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.53 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.53 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.53 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.53 |
| ▸ | AKR1B1 | P15121 | 13/20 | 0.53 |
| ▸ | AKR1A1 | P14550 | 12/20 | 0.53 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15955872 | 0.89 | CYP2C9 (0.73) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL22380789 | 0.81 | CYP2C9 (0.61) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL3660535 | 0.79 | CYP2C9 (0.64) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL20291006 | 0.76 | CYP2C9 (0.59) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL26232326 | 0.75 | CYP2C9 (0.56) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL25892779 | 0.73 | CYP2C9 (0.51) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL10929665 | 0.73 | CYP2C9 (0.79) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| SCHEMBL9674175 | 0.73 | AKR1A1 (0.60) | AKR1B1AKR1A1ITGA4 | |
| SCHEMBL20290102 | 0.72 | AKR1B1 (0.73) | CYP2C9CACNA1FALDH1A1MAPTHTR2A | |
| Phenytoin SCHEMBL3440 | 0.70 | CYP2C9 (1.00) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5153211-A | Enzyme inhibitors | ALCON LABORATORIES, INC. (US) | 1992-10-06 | — | — | US | disclosed |
| US-5070100-A | COMPLICATIONS OF DIABETES | ALCON LABORATORIES, INC. (US) | 1991-12-03 | — | — | US | disclosed |
| US-4864028-A | ANTIDIABETIC AGENTS | ALCON LABORATORIES, INC. (US) | 1989-09-05 | — | — | US | disclosed |