Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.49 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | CES1 | P23141 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | FOS | P01100 | 1/20 | 0.44 |
| ▸ | JUN | P05412 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| M-Xylene SCHEMBL30345558 | 0.83 | TP53 (0.56) | ACHELMNAGAAMAPTPARP1 | |
| 1-Hydroxy-3-Methoxybenzene SCHEMBL28835526 | 0.83 | ESR1 (0.58) | LMNACES2CES1RELAMAPT | |
| Acrylic Acid SCHEMBL28304089 | 0.81 | CES2 (0.51) | LMNAKCNK3KCNK9CES2CES1 | |
| Anisole SCHEMBL7290982 | 0.81 | CA4 (0.61) | GAACES2CES1RELAMAPT | |
| SCHEMBL12353 | 0.81 | — | — | |
| SCHEMBL28273748 | 0.81 | ACHE (1.00) | ACHELMNAGAAKCNK3KCNK9 | |
| SCHEMBL29369744 | 0.81 | — | — | |
| Anisole SCHEMBL28780062 | 0.80 | CA4 (0.58) | GAACES2CES1RELAMAPT | |
| Anisole SCHEMBL28301167 | 0.79 | ACHE (0.86) | ACHELMNAGAARELAMAOB | |
| Ammonia Solution, Strong SCHEMBL20593656 | 0.79 | ACHE (0.95) | ACHELMNAGAAKCNK3KCNK9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5063225-A | Antiarrhythmia | ROUSSEL UCLAF (FR) | 1991-11-05 | — | — | US | disclosed |