Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.48 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | CLPP | Q16740 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | BRS3 | P32247 | 1/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2301297 | 0.93 | ACHE (0.54) | ACHESLC6A5AKR1B1GABRA1GABRA2 | |
| SCHEMBL6908510 | 0.90 | ACHE (0.46) | ACHESLC6A5AKR1B1MEN1KMT2A | |
| SCHEMBL2299422 | 0.89 | CLPP (0.53) | ACHESLC6A5AKR1B1GABRA1GABRA2 | |
| SCHEMBL2300918 | 0.89 | CLPP (0.53) | ACHESLC6A5AKR1B1GABRA1GABRA2 | |
| SCHEMBL2310779 | 0.85 | CLPP (0.46) | ACHESLC6A5AKR1B1MEN1KMT2A | |
| SCHEMBL2301137 | 0.85 | SIGMAR1 (0.53) | ACHESLC6A5AKR1B1MEN1KMT2A | |
| SCHEMBL2303283 | 0.85 | ACHE (0.56) | ACHEKMT2AGABRA1GABRA2CLPP | |
| SCHEMBL6907424 | 0.85 | ALDH1A1 (0.42) | ACHESLC6A5AKR1B1MEN1KMT2A | |
| SCHEMBL2339909 | 0.85 | ACHE (0.47) | ACHESLC6A5AKR1B1MEN1KMT2A | |
| SCHEMBL6907587 | 0.84 | ALDH1A1 (0.49) | ACHESLC6A5CLPPKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011101804-A1 | PYRAZOLO PIPERIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS | GENKYOTEX SA (CH) | 2011-08-25 | — | — | WO | disclosed |