Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | ACACA | Q13085 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14066725 | 0.88 | MAPT (0.32) | PTGS2ALDH1A1ACACBACACAKMT2A | |
| SCHEMBL823041 | 0.79 | ALDH1A1 (0.33) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL812008 | 0.79 | ACACB (0.30) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL13359403 | 0.78 | MMP1 (0.33) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL812037 | 0.77 | PGR (0.34) | PTGS2ALDH1A1ACACBACACAKMT2A | |
| SCHEMBL14066574 | 0.77 | ACACB (0.38) | PTGS2ALDH1A1CYP1A2CYP2C19ACACB | |
| SCHEMBL14066722 | 0.72 | ACACB (0.36) | PTGS2ACACBACACA | |
| SCHEMBL812007 | 0.70 | PGR (0.40) | PTGS2ALDH1A1ACACBACACAMEN1 | |
| SCHEMBL811909 | 0.67 | ACACB (0.38) | ALDH1A1HPGDACACBACACAMEN1 | |
| SCHEMBL812048 | 0.65 | LMNA (0.38) | ALDH1A1ACACBACACAMEN1KMT2A |
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-1303505-B1 | PHENYL-SUBSTITUTED 5,6-DIHYDROPYRONE DERIVATIVES FOR USE AS PESTICIDES AND HERBICIDES | BAYER CROPSCIENCE AG (DE) | 2008-09-03 | — | — | EP | disclosed |