Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | HPD | P32754 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8980332 | 0.83 | SMN1; SMN2 (0.39) | CYP1A2CYP3A4HPGDCYP2C19SMN1; SMN2 | |
| SCHEMBL8980419 | 0.83 | SMN1; SMN2 (0.43) | CYP1A2CYP3A4HPGDCYP2C19NPC1 | |
| SCHEMBL8980434 | 0.82 | FLT1 (0.39) | CYP1A2CYP3A4HPGDCYP2C19SMN1; SMN2 | |
| SCHEMBL9711555 | 0.79 | HPGD (0.43) | CYP1A2CYP3A4HPGDCYP2C19NPC1 | |
| SCHEMBL9711617 | 0.73 | HPGD (0.47) | CYP1A2CYP3A4HPGDCYP2C19NPC1 | |
| SCHEMBL9711509 | 0.69 | HPGD (0.43) | CYP1A2CYP3A4HPGDCYP2C19NPC1 | |
| SCHEMBL9191354 | 0.69 | HPD (0.67) | CYP1A2CYP3A4HPGDCYP2C19NPC1 | |
| SCHEMBL9191312 | 0.69 | HPD (0.42) | CYP1A2CYP3A4HPGDCYP2C19SMN1; SMN2 | |
| SCHEMBL9234637 | 0.69 | SMN1; SMN2 (0.45) | CYP1A2CYP3A4HPGDCYP2C19NPC1 | |
| SCHEMBL10584278 | 0.68 | ALDH1A1 (0.44) | CYP1A2CYP3A4HPGDCYP2C19NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5504056-A | Heterocyclic cyclohexanedione derivative, production thereof, and herbicide | NIPPON SODA CO., LTD. (JP) | 1996-04-02 | — | — | US | disclosed |
| EP-0641780-A1 | HETEROCYCLIC CYCLOHEXANEDIONE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE | NIPPON SODA CO., LTD. (JP) | 1995-03-08 | — | — | EP | disclosed |