Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 7/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8218995 | 0.84 | CYP3A4 (0.47) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL8211453 | 0.84 | CYP3A4 (0.47) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL8206184 | 0.83 | CYP3A4 (0.46) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL8211608 | 0.83 | POLB (0.47) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL8211538 | 0.82 | KIF11 (0.44) | NPC1CYP2C19ALDH1A1 | |
| SCHEMBL8213028 | 0.82 | CYP3A4 (0.48) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL11926882 | 0.81 | CYP3A4 (0.42) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL11925462 | 0.81 | EPHX1 (0.47) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL8214015 | 0.81 | CYP3A4 (0.49) | EPHX1EPHX2RAB9AGAANPC1 | |
| SCHEMBL8217047 | 0.81 | EPHX1 (0.46) | EPHX1EPHX2RAB9AGAANPC1 |
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-2008023159-A1 | MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2008-02-28 | — | — | WO | disclosed |