Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.31 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8331492 | 0.83 | EPHX1 (0.35) | HTTEPHX1KDM4ESMN1; SMN2NAAA | |
| SCHEMBL7757456 | 0.82 | EPHX1 (0.34) | HTTEPHX1NAAACYP19A1CYP2C19 | |
| SCHEMBL7792497 | 0.77 | EPHX1 (0.33) | HTTEPHX1KDM4ESMN1; SMN2NAAA | |
| SCHEMBL7783004 | 0.76 | MMP8 (0.33) | — | |
| SCHEMBL7782923 | 0.74 | EPHX1 (0.35) | HTTEPHX1SMN1; SMN2NAAACYP19A1 | |
| SCHEMBL5677020 | 0.71 | EPHX1 (0.43) | HTTEPHX1SMN1; SMN2NAAACYP19A1 | |
| SCHEMBL7790600 | 0.70 | APOBEC3A (0.40) | HTTKDM4ESMN1; SMN2CYP19A1APOBEC3A | |
| SCHEMBL9123245 | 0.69 | EPHX1 (0.40) | HTTEPHX1SMN1; SMN2NAAACYP19A1 | |
| SCHEMBL7788674 | 0.69 | EPHX1 (0.36) | HTTEPHX1SMN1; SMN2NAAACYP19A1 | |
| SCHEMBL7783005 | 0.68 | MAPK1 (0.31) | — |
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-0850928-B1 | Novel peroxyoxalates derived from hydroxy-hydroperoxides | ATOFINA CHEM INC (US) | 2001-10-31 | — | — | EP | disclosed |