Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 10/20 | 0.60 |
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | PPARG | P37231 | 2/20 | 0.58 |
| ▸ | PPARA | Q07869 | 2/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL1206101 | 0.90 | PPARA (0.64) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL22526149 | 0.88 | KMT2A (0.55) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL12255204 | 0.87 | CYP2D6 (0.59) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL720798 | 0.85 | CYP2D6 (0.58) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL25456542 | 0.84 | PPARA (0.69) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL17345289 | 0.84 | PPARA (0.61) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL17345292 | 0.84 | PPARA (0.69) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL14382693 | 0.84 | CYP2D6 (0.57) | CYP2D6PLA2G4BKCNH2PPARGPPARA | |
| SCHEMBL28589342 | 0.83 | CYP2D6 (0.61) | CYP2D6KCNH2PPARGPPARACNR1 | |
| SCHEMBL8053831 | 0.83 | CYP2D6 (0.56) | CYP2D6PLA2G4BKCNH2PPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| CN-108368102-A | 2- amino -1,3,4- thiadiazines and antifungal agent based on 2- amino -1,3,4- oxadiazines | F2G有限公司 | 2018-08-03 | — | — | CN | disclosed |