Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | IFNAR1 | P17181 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7018449 | 0.81 | SIGMAR1 (0.53) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL9727662 | 0.79 | CTNNB1 (0.45) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL25660784 | 0.79 | CTNNB1 (0.45) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL9631575 | 0.79 | CTNNB1 (0.45) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL11397476 | 0.78 | SIGMAR1 (0.37) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL11407941 | 0.76 | MME (0.36) | SIGMAR1CTNNB1ADRB2MMP9 | |
| SCHEMBL9727658 | 0.70 | CTNNB1 (0.45) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL9631571 | 0.70 | CTNNB1 (0.45) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL31332073 | 0.69 | NR3C1 (0.54) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL16174128 | 0.69 | NR3C1 (0.54) | SIGMAR1CTNNB1CYP1A2CYP2C19CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0024587-A1 | Propenylamines, processes for their production, pharmaceutical compositions containing them and their use as pharmaceuticals | SANDOZ AG (CH) | 1981-03-11 | — | — | EP | disclosed |