Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9215334 | 0.90 | CYP1A2 (0.52) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9475471 | 0.89 | ALDH1A1 (0.59) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9685112 | 0.85 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9129900 | 0.83 | LMNA (0.46) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9754449 | 0.82 | ALDH1A1 (0.49) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9682714 | 0.82 | ALDH1A1 (0.47) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9615079 | 0.82 | ALDH1A1 (0.52) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9754622 | 0.82 | CYP1A2 (0.47) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9128119 | 0.82 | LMNA (0.45) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 | |
| SCHEMBL9128103 | 0.81 | CYP1A2 (0.43) | CYP1A2CYP2C9CYP2C19CYP3A4NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-4210972-A | — | — | None | — | — | JP | disclosed |
| JP-H04210972-A | SALICYLIC ACID DERIVATIVE, ITS PREPARATION AND HERBICIDE AND BIOREGULATOR CONTAINING IT | BASF AG | 1992-08-03 | — | — | JP | disclosed |
| US-5100458-A | Pyrimidine substituted, plant growth regulators | BASF AKTIENGESELLSCHAFT (DE) | 1992-03-31 | — | — | US | disclosed |