Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | PDE2A | O00408 | 5/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16633984 | 0.86 | ALDH1A1 (0.43) | EPHX1PDE2AEPHX2ALDH1A1TRPV1 | |
| SCHEMBL27985787 | 0.85 | EPHX1 (0.42) | EPHX1PDE2AEPHX2ALDH1A1HRH3 | |
| SCHEMBL19946342 | 0.82 | KIF11 (0.44) | PDE2AAKR1C2 | |
| SCHEMBL19946338 | 0.80 | PDE2A (0.64) | PDE2AEPHX2 | |
| SCHEMBL27985789 | 0.77 | EPHX1 (0.46) | EPHX1PDE2AEPHX2ALDH1A1TRPV1 | |
| SCHEMBL22758079 | 0.75 | EPHX1 (0.52) | EPHX1PDE2AEPHX2ALDH1A1TRPV1 | |
| SCHEMBL27974375 | 0.75 | EPHX2 (0.41) | EPHX1PDE2AEPHX2ALDH1A1TRPV1 | |
| SCHEMBL27985769 | 0.75 | EPHX1 (0.44) | EPHX1EPHX2ALDH1A1HRH3NOS3 | |
| SCHEMBL27985768 | 0.75 | EPHX1 (0.44) | EPHX1EPHX2ALDH1A1HRH3NOS3 | |
| SCHEMBL28114748 | 0.74 | PDE2A (0.60) | EPHX1PDE2AEPHX2ALDH1A1TRPV1 |
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-2848618-B1 | NITROGENATED HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2018-03-14 | — | — | EP | disclosed |