Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20049258 | 0.83 | AKR1C3 (0.31) | AKR1C3AKR1C2 | |
| SCHEMBL20049296 | 0.80 | ALDH1A1 (0.33) | KCNH2HRH4HRH3 | |
| SCHEMBL20047653 | 0.80 | — | — | |
| SCHEMBL20049293 | 0.73 | KCNH2 (0.33) | KCNH2HRH4HRH3 | |
| SCHEMBL20049379 | 0.71 | — | — | |
| SCHEMBL20049295 | 0.70 | NPC1 (0.41) | — | |
| SCHEMBL14652456 | 0.70 | NPC1 (0.41) | — | |
| SCHEMBL20049057 | 0.70 | NOS3 (0.37) | — | |
| SCHEMBL20047594 | 0.68 | — | — | |
| SCHEMBL24019234 | 0.68 | OGA (0.30) | — |
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-2018067704-A1 | ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2018-04-12 | — | — | WO | disclosed |