Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | METAP1 | P53582 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL7313982 | 0.95 | ACHE (0.47) | ACHESIGMAR1METAP1HTR2CHTR7 | |
| SCHEMBL7344655 | 0.94 | METAP1 (0.45) | ACHESIGMAR1METAP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7345539 | 0.91 | METAP1 (0.46) | ACHESIGMAR1METAP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7340887 | 0.88 | METAP1 (0.48) | ACHESIGMAR1METAP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7305377 | 0.82 | METAP1 (0.59) | ACHESIGMAR1METAP1HTR2CCYP19A1 | |
| SCHEMBL7304546 | 0.81 | ACHE (0.47) | ACHESIGMAR1METAP1HTR2CHTR7 | |
| Hydrochloric Acid SCHEMBL9426279 | 0.80 | METAP1 (0.47) | ACHESIGMAR1METAP1HTR2CHTR7 | |
| SCHEMBL7315694 | 0.78 | MAOB (0.47) | SIGMAR1ALDH1A1CYP19A1 | |
| SCHEMBL7337797 | 0.78 | CYP19A1 (0.44) | ACHESIGMAR1METAP1HTR2CALDH1A1 | |
| SCHEMBL7345441 | 0.77 | CYP24A1 (0.53) | ACHEMETAP1CYP19A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0581677-B1 | Cycloalkylalkylamines which are sigma-receptor ligands, process for preparing them and their application in therapy | JOUVEINAL INST RECH (FR) | 1997-01-08 | — | — | EP | disclosed |
| US-5326784-A | Psychological and gastrointestinal disorders | INSTITUT DE RECHERCHE JOUVEINAL (FR) | 1994-07-05 | — | — | US | disclosed |
| EP-0581677-A1 | Cycloalkylalkylamines which are sigma-receptor ligands, process for preparing them and their application in therapy | INSTITUT DE RECHERCHE JOUVEINAL (I.R.J) (FR) | 1994-02-02 | — | — | EP | disclosed |