Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.36 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10884315 | 0.84 | FDPS (0.48) | FDPSHSP90AA1CYP3A4ALDH1A1LMNA | |
| SCHEMBL4640786 | 0.77 | FDPS (0.56) | FDPSHSP90AA1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10515723 | 0.75 | FDPS (0.51) | FDPSHSP90AA1CYP3A4ALDH1A1LMNA | |
| SCHEMBL9000191 | 0.72 | FDPS (0.43) | FDPSALDH1A1EGLN3KMT2APPARD | |
| SCHEMBL9000139 | 0.70 | FDPS (0.41) | FDPSEGLN3KMT2APPARDTSHR | |
| SCHEMBL10881742 | 0.70 | POLB (0.40) | FDPS | |
| SCHEMBL11168444 | 0.69 | FDPS (0.56) | FDPSHSP90AA1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10706453 | 0.69 | KMT2A (0.52) | FDPSHSP90AA1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10707027 | 0.69 | KMT2A (0.52) | FDPSHSP90AA1CYP3A4ALDH1A1LMNA | |
| SCHEMBL9000197 | 0.69 | FDPS (0.36) | FDPSALDH1A1EGLN3TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0078613-B1 | SUBSTITUTED PROPYL PHOSPHONIC ACID DERIVATIVES, THEIR USE AS HERBICIDES, HERBICIDAL COMPOSITIONS CONTAINING THEM, AND METHODS OF PREPARING THEM | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-10-01 | — | — | EP | disclosed |
| US-4439428-A | 1,2,4-TRIAZOL-1-YL-ALKYLENE PHOSPHONIC ACIDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-03-27 | — | — | US | disclosed |
| EP-0078613-A1 | Substituted propyl phosphonic acid derivatives, their use as herbicides, herbicidal compositions containing them, and methods of preparing them | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-05-11 | — | — | EP | disclosed |