Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 4/20 | 0.34 |
| ▸ | AGXT | P21549 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.31 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.31 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.31 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.31 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9520788 | 0.79 | — | — | |
| Hydroxyamine SCHEMBL8659777 | 0.79 | — | — | |
| SCHEMBL29040553 | 0.79 | ACHE (0.30) | ACHE | |
| SCHEMBL6892878 | 0.79 | ACHE (0.30) | ACHE | |
| SCHEMBL29894137 | 0.78 | CHKA (0.32) | CYP3A4ALDH1A1ACHECA2CA9 | |
| Ammonia Solution, Strong SCHEMBL3063865 | 0.78 | — | — | |
| SCHEMBL30945595 | 0.78 | CHKA (0.32) | CYP3A4ALDH1A1ACHECA2CA9 | |
| SCHEMBL30547267 | 0.78 | CHKA (0.32) | CYP3A4ALDH1A1ACHECA2CA9 | |
| Water SCHEMBL5062444 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL27669855 | 0.77 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0674232-B1 | Recording sheets | XEROX CORP (US) | 2000-05-31 | — | — | EP | claimed |
| EP-0593639-A1 | PYRROLIDINE AND THIAZOLIDINE DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME. | RHONE POULENC RORER SA (FR) | 1994-04-27 | — | — | EP | disclosed |
| WO-1993001167-A1 | PYRROLIDINE AND THIAZOLIDINE DERIVATIVES, PREPARATION THEREOF AND DRUGS CONTAINING SAME | RHONE-POULENC RORER S.A. (FR) | 1993-01-21 | — | — | WO | disclosed |
| EP-0091385-B1 | PROCESS FOR THE PREPARATION OF P-HYDROXYBENZYL NITRILES OR P-HYDROXYBENZYL AMINES | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1985-06-12 | — | — | EP | disclosed |
| EP-0091385-A1 | Process for the preparation of p-hydroxybenzyl nitriles or p-hydroxybenzyl amines | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1983-10-12 | — | — | EP | disclosed |