Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.50 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | CPA1 | P15085 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6312723 | 0.92 | CPA1 (0.50) | TRPA1PPARGPPARACPA1GAA | |
| SCHEMBL9317096 | 0.89 | LDHA (0.52) | MDM2LDHAESR1ESR2 | |
| SCHEMBL855971 | 0.86 | NOS2 (0.50) | PPARGPPARAGAALDHAESR1 | |
| SCHEMBL2429506 | 0.84 | PPARG (0.50) | TRPA1PPARGGAAMAPK1HPGD | |
| SCHEMBL6212574 | 0.84 | TRPA1 (0.47) | TRPA1PPARGPPARACPA1HPGD | |
| SCHEMBL17892867 | 0.83 | TRPA1 (0.50) | TRPA1PPARGCPA1HPGDTDP1 | |
| SCHEMBL754625 | 0.83 | LDHA (0.57) | TRPA1MDM2PPARGPPARACPA1 | |
| SCHEMBL3779844 | 0.82 | TRPA1 (0.39) | TRPA1CPA1GAAMAPK1LDHA | |
| SCHEMBL5807390 | 0.82 | TRPA1 (0.48) | TRPA1PPARGPPARACPA1GAA | |
| SCHEMBL13253992 | 0.82 | SLC7A5 (0.48) | TRPA1CPA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004096808-A1 | TRIAZINE COMPOUNDS AND THEIR USE | DE NOVO PHARMACEUTICALS LIMITED (GB) | 2004-11-11 | — | — | WO | disclosed |