Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | ACP3 | P15309 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8470103 | 0.91 | CYP2C9 (0.48) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9853050 | 0.79 | SLC6A4 (0.54) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL12506240 | 0.78 | SLC6A4 (0.65) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL3744199 | 0.77 | ALDH1A1 (0.46) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL833319 | 0.77 | HTR2A (0.46) | ALDH1A1TSHR | |
| SCHEMBL5010133 | 0.77 | SLC6A4 (0.58) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL613009 | 0.77 | SLC6A4 (0.58) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL28326874 | 0.76 | CYP2C9 (0.59) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL6006319 | 0.74 | SLC6A4 (0.64) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL16721029 | 0.74 | SLC6A4 (0.64) | SLC6A4ALDH1A1CYP2C9CYP2C19CYP1A2 |
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-0441226-A1 | (cyanomethyl)pyridines useful as PAF antagonists | J. URIACH & CIA. S.A. (ES) | 1991-08-14 | — | — | EP | disclosed |