Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.38 |
| ▸ | GLRB | P48167 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.35 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10880263 | 0.93 | GLRA3 (0.41) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL10882748 | 0.90 | ESR1 (0.38) | CYP2C9CYP1A2MEN1KMT2ACYP3A4 | |
| SCHEMBL10881458 | 0.86 | KIF11 (0.38) | CYP2C9CYP2C19CYP1A2CYP3A4TSHR | |
| SCHEMBL10881026 | 0.84 | CYP1A2 (0.42) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL10880670 | 0.82 | ALDH1A1 (0.36) | CYP2C9CYP2C19CYP1A2SMN1; SMN2L3MBTL1 | |
| SCHEMBL10880865 | 0.82 | ALDH1A1 (0.51) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL10894019 | 0.78 | CYP2C9 (0.46) | CYP2C9CYP2C19CYP1A2SMN1; SMN2CYP3A4 | |
| SCHEMBL10882031 | 0.78 | GABRA1 (0.35) | CYP2C9CYP2C19CYP1A2HTTTSHR | |
| SCHEMBL10880186 | 0.78 | TTR (0.37) | CYP2C9CYP2C19CYP1A2SMN1; SMN2TSHR | |
| SCHEMBL10882334 | 0.78 | GAA (0.42) | CYP1A2HTTALDH1A1CA2LMNA |
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-0106799-A1 | Phenols and their preparation | CIBA-GEIGY AG (CH) | 1984-04-25 | — | — | EP | disclosed |