Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | METAP1 | P53582 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9425957 | 0.99 | CYP19A1 (0.49) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| SCHEMBL8489825 | 0.84 | CYP19A1 (0.57) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| SCHEMBL7301242 | 0.83 | CYP19A1 (0.53) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| Hydrochloric Acid SCHEMBL9426264 | 0.82 | CYP19A1 (0.52) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| SCHEMBL7302478 | 0.82 | CYP19A1 (0.52) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| SCHEMBL24228697 | 0.81 | CYP19A1 (0.57) | CYP19A1HTR2CHTR1ASIGMAR1ACHE | |
| Hydrochloric Acid SCHEMBL9425589 | 0.81 | METAP1 (0.51) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| SCHEMBL7304691 | 0.80 | CYP19A1 (0.53) | CYP19A1METAP1HTR2CHTR1ASIGMAR1 | |
| SCHEMBL11026228 | 0.80 | CYP19A1 (0.49) | CYP19A1METAP1HTR1ASIGMAR1ACHE | |
| SCHEMBL7586745 | 0.80 | METAP1 (0.48) | CYP19A1METAP1HTR2CSIGMAR1ACHE |
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 |