Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.44 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.44 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.44 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.44 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.44 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.44 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.44 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.44 |
| ▸ | CACNG7 | P62955 | 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 | |
|---|---|---|---|---|
| SCHEMBL6057386 | 0.91 | HRH3 (0.59) | HRH3ALDH1A1CYP2D6CYP2C19KDM4E | |
| SCHEMBL1777747 | 0.79 | SIGMAR1 (0.81) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL13952 | 0.79 | SIGMAR1 (0.81) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL11585348 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL3699405 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL688047 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| Bromide SCHEMBL10447698 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL8327 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL11141692 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL26532 | 0.77 | SIGMAR1 (0.77) | SIGMAR1HRH3ALDH1A1CYP2D6CYP2C19 |
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-4996224-A | 1-benzyl-4- or 5-pyrrolidinomethyl-pyrrolidin-2-ones and nootropic method of use thereof | BOEHRINGER INGELHEIM KG (DE) | 1991-02-26 | — | — | US | disclosed |