Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL2884868 | 0.93 | DPP4 (0.35) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL29353415 | 0.87 | ALDH1A1 (0.38) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL56503 | 0.87 | ALDH1A1 (0.38) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL31379087 | 0.86 | CYP2A6 (0.34) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL2642874 | 0.85 | ALDH1A1 (0.37) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL18096530 | 0.85 | ALDH1A1 (0.37) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL2249411 | 0.85 | ALDH1A1 (0.37) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL705644 | 0.85 | ALDH1A1 (0.37) | DPP4PDCD1CD274ALDH1A1HSD17B10 | |
| SCHEMBL31634975 | 0.85 | CYP2A6 (0.33) | DPP4PDCD1CD274CYP2A6 | |
| Hydrochloric Acid SCHEMBL15608549 | 0.83 | ALDH1A1 (0.35) | DPP4PDCD1CD274ALDH1A1HSD17B10 |
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-3099658-B1 | PROCESS OF PRODUCTION OF 2,3,6-TRIMETHYLPHENOL | DSM IP ASSETS BV (NL) | 2018-02-28 | — | — | EP | disclosed |