Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.60 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.59 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.54 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.54 |
| ▸ | ITGAL | P20701 | 3/20 | 0.54 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | GGT1 | P19440 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16364167 | 0.87 | SLC6A5 (0.62) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL29071832 | 0.85 | SLC6A5 (0.63) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL19051473 | 0.85 | SLC6A5 (0.63) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL29615190 | 0.85 | EPHX2 (0.60) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL21089945 | 0.85 | EPHX2 (0.60) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL27675779 | 0.85 | EPHX2 (0.60) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL3057446 | 0.85 | EPHX2 (0.60) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| Carnosine SCHEMBL22392772 | 0.84 | SLC15A2 (0.63) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| Carnosine SCHEMBL1160796 | 0.84 | SLC15A2 (0.63) | EPHX2SLC6A5ITGB2ICAM1ITGAL | |
| SCHEMBL11492255 | 0.84 | SLC6A5 (0.61) | EPHX2SLC6A5ITGB2ICAM1ITGAL |
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-2018029545-A1 | COMPOSITIONS AND METHODS FOR THE TREATMENT OF IRRITABLE BOWEL SYNDROME | CELLIX BIO PRIVATE LIMITED (IN) | 2018-02-15 | — | — | WO | disclosed |