Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 6/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13765447 | 0.86 | DHODH (0.31) | DHODH | |
| SCHEMBL3456290 | 0.77 | DRD2 (0.37) | DRD2HTR2AHRH1APLNRDHODH | |
| SCHEMBL3758629 | 0.72 | NPSR1 (0.49) | — | |
| SCHEMBL13765589 | 0.69 | ROCK2 (0.30) | — | |
| SCHEMBL3455921 | 0.69 | TP53 (0.47) | — | |
| Bicarbonate SCHEMBL3457190 | 0.69 | NPSR1 (0.46) | — | |
| SCHEMBL13765530 | 0.69 | GSK3B (0.34) | — | |
| SCHEMBL13765502 | 0.68 | KCNN4 (0.33) | — | |
| SCHEMBL13765593 | 0.66 | MEN1 (0.36) | — | |
| SCHEMBL20405679 | 0.66 | KCNN4 (0.32) | — |
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-2009080663-A1 | TRIAZOLE OXADIAZOLES DERIVATIVES | MERCK SERONO S.A. (CH) | 2009-07-02 | — | — | WO | disclosed |