Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8918450 | 0.92 | EPHX2 (0.56) | EPHX2CHEK1PRKCAFLT3GSK3B | |
| SCHEMBL8916125 | 0.89 | EPHX2 (0.59) | EPHX2HRH4METAP2HTR3EHTR3B | |
| SCHEMBL9375677 | 0.79 | SLC29A1 (0.51) | EPHX2 | |
| SCHEMBL8917576 | 0.78 | EPHX2 (0.49) | EPHX2CHEK1MAPK1HTR3EHTR3B | |
| SCHEMBL22597906 | 0.76 | EPHX2 (0.49) | EPHX2CHEK1MAPK1HTR3EHTR3B | |
| SCHEMBL8919131 | 0.74 | EPHX2 (0.52) | EPHX2FLT3HTR3EHTR3BHTR1A | |
| Propionic Acid SCHEMBL9640910 | 0.74 | PARP1 (0.53) | EPHX2PARP1HTR3EHTR3BHTR1A | |
| SCHEMBL3334093 | 0.73 | EPHX2 (0.51) | EPHX2FLT3PARP1HTR3EHTR3B | |
| SCHEMBL7833448 | 0.72 | CHEK1 (0.50) | CHEK1MAPK1 | |
| Hydrochloric Acid SCHEMBL8703350 | 0.72 | EPHX2 (0.50) | EPHX2FLT3PARP1HTR3EHTR3B |
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-0594702-A1 | SUBSTITUTED INDOLES AS ANTI-AIDS PHARMACEUTICALS. | UPJOHN CO (US) | 1994-05-04 | — | — | EP | disclosed |