Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.45 |
| ▸ | DRD4 | P21917 | 5/20 | 0.45 |
| ▸ | CLPP | Q16740 | 3/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | BRS3 | P32247 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| SCHEMBL2341826 | 0.91 | DRD4 (0.51) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL6909376 | 0.89 | KMT2A (0.51) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL2302677 | 0.87 | DRD2 (0.46) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL2303047 | 0.82 | ALDH1A1 (0.47) | DRD2DRD4CLPPACHEKMT2A | |
| SCHEMBL2304287 | 0.81 | DRD2 (0.51) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL2337803 | 0.80 | KDM4E (0.54) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL2301114 | 0.79 | ACHE (0.56) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL6909775 | 0.79 | CLPP (0.43) | CLPPMAPTKMT2ABRS3KDM4E | |
| SCHEMBL2303283 | 0.78 | ACHE (0.56) | DRD2DRD4CLPPACHEGABRA1 | |
| SCHEMBL2302421 | 0.77 | MEN1 (0.56) | CLPPACHEGABRA1GABRA2KMT2A |
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 |