Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.42 |
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.42 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.40 |
| ▸ | ADH5 | P11766 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | PTPRC | P08575 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL410339 | 0.91 | AKR1C3 (0.47) | GPBAR1AKR1C3AKR1C2SRD5A2ADH5 | |
| SCHEMBL319595 | 0.89 | GPBAR1 (0.49) | RORCGPBAR1AKR1C3AKR1C2RARB | |
| SCHEMBL319915 | 0.83 | RORC (0.52) | RORCAKR1C3AKR1C2SRD5A2S1PR1 | |
| SCHEMBL272092 | 0.79 | TTR (0.56) | SRD5A2PTPRC | |
| SCHEMBL536675 | 0.78 | NOTUM (0.51) | AKR1C3AKR1C2 | |
| SCHEMBL272324 | 0.77 | PTPRC (0.54) | AKR1C3AKR1C2SRD5A2ADH5PTPRC | |
| SCHEMBL336261 | 0.76 | ADH5 (0.54) | AKR1C3AKR1C2RARBSRD5A2ADH5 | |
| SCHEMBL320542 | 0.75 | NOTUM (0.54) | GPBAR1AKR1C3AKR1C2S1PR1 | |
| SCHEMBL13601649 | 0.75 | RORC (0.49) | RORCGPBAR1AKR1C3AKR1C2RARB | |
| SCHEMBL13601671 | 0.75 | RORC (0.47) | RORCAKR1C3AKR1C2RARBSRD5A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2414342-A1 | OXADIAZOLE DERIVATIVES | Merck Serono S.A. (CH) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010112461-A1 | OXADIAZOLE DERIVATIVES | MERCK SERONO S.A. (CH) | 2010-10-07 | — | — | WO | disclosed |