Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HEXA | P06865 | 1/20 | 0.38 |
| ▸ | HEXB | P07686 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL27272575 | 0.92 | PPARA (0.41) | PPARACYP2C19PTGS2FFAR4FFAR1 | |
| SCHEMBL11994144 | 0.89 | PPARA (0.44) | PPARACYP2C19PTGS2FFAR4FFAR1 | |
| SCHEMBL10058354 | 0.84 | PTGS2 (0.52) | PPARACYP2C19PTGS2FFAR4FFAR1 | |
| SCHEMBL10798302 | 0.84 | DPP4 (0.52) | PPARAFFAR4FFAR1HTR7DPP4 | |
| SCHEMBL607543 | 0.84 | DPP4 (0.56) | PPARAHTR7DPP4 | |
| SCHEMBL3746992 | 0.82 | CYP2C19 (0.50) | CYP2C19PTGS2FFAR4FFAR1HTR7 | |
| SCHEMBL28312674 | 0.82 | PPARA (0.47) | PPARAFFAR4FFAR1HTR7DPP4 | |
| SCHEMBL15238788 | 0.82 | PPARA (0.50) | PPARAFFAR4FFAR1DPP4LTB4R2 | |
| Hydrochloric Acid SCHEMBL30641921 | 0.82 | DPP4 (0.54) | PPARAHTR7SLC6A4SLC6A3DPP4 | |
| SCHEMBL4266903 | 0.81 | MEN1 (0.43) | FFAR4FFAR1HTTHEXAHEXB |
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-2015049616-A1 | NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS | PFIZER INC. (US) | 2015-04-09 | — | — | WO | disclosed |