Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 5/20 | 0.60 |
| ▸ | ADH1B | P00325 | 3/20 | 0.60 |
| ▸ | ADH1A | P07327 | 3/20 | 0.60 |
| ▸ | ADH7 | P40394 | 3/20 | 0.60 |
| ▸ | ADH1C | P00326 | 2/20 | 0.60 |
| ▸ | ADH4 | P08319 | 1/20 | 0.60 |
| ▸ | CASP2 | P42575 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.39 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19242166 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL10925262 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL11787118 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL11344208 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL14166641 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL10785417 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL9770398 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL14478082 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL14478084 | 0.80 | CES2 (0.54) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL31122627 | 0.79 | SMN1; SMN2 (0.53) | EPHX1CASP2NAAAALDH1A1TSHR |
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-2020113209-A1 | PANTETHEINE DERIVATIVES AND USES THEREOF | COMET THERAPEUTICS, INC. (US) | 2020-06-04 | — | — | WO | disclosed |