Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.51 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.51 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.51 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 9/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL22171634 | 0.89 | HSD11B1 (0.50) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL278789 | 0.86 | GAA (0.47) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL10343225 | 0.85 | TRPA1 (0.51) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL26375409 | 0.85 | HSD11B1 (0.50) | TRPA1TRPM8TRPV1HSD11B1PDK2 | |
| SCHEMBL26262316 | 0.82 | TRPA1 (0.49) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL5541462 | 0.82 | HSD11B1 (0.55) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL26262326 | 0.80 | TRPA1 (0.47) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL23373938 | 0.79 | GAA (0.40) | TRPA1TRPM8TRPV1S1PR1HSD11B1 | |
| SCHEMBL2600185 | 0.79 | GAA (0.69) | PDK2AKR1C3AKR1C2TSHRMEN1 | |
| SCHEMBL5964273 | 0.78 | TRPA1 (0.46) | TRPA1TRPM8TRPV1S1PR1HSD11B1 |
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-2010112461-A1 | OXADIAZOLE DERIVATIVES | MERCK SERONO S.A. (CH) | 2010-10-07 | — | — | WO | disclosed |