Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | EDNRB | P24530 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL14917721 | 0.95 | EPHX1 (0.51) | EPHX1ALOX5NR3C2ALDH1A1TDP1 | |
| SCHEMBL14917822 | 0.94 | EPHX1 (0.50) | EPHX1ALOX5NR3C2ALDH1A1TDP1 | |
| SCHEMBL5329154 | 0.86 | CYP2C19 (0.47) | EPHX1CYP2C19CYP2D6SMN1; SMN2CTSS | |
| SCHEMBL8513332 | 0.81 | EPHX1 (0.58) | EPHX1ALOX5ALDH1A1TDP1CYP2C19 | |
| SCHEMBL1061595 | 0.81 | EPHX1 (0.58) | EPHX1ALOX5CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL19205724 | 0.81 | EPHX1 (0.58) | EPHX1ALOX5CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL1065526 | 0.79 | EPHX1 (0.56) | EPHX1ALOX5CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL14917987 | 0.79 | EPHX1 (0.56) | EPHX1ALOX5ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL528414 | 0.79 | EPHX1 (0.56) | EPHX1ALOX5ALDH1A1NPSR1LMNA | |
| SCHEMBL27408198 | 0.79 | EPHX1 (0.56) | EPHX1ALOX5ALDH1A1CYP2C19CYP1A2 |
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-2013066836-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2013-05-10 | — | — | WO | disclosed |