Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16961704 | 0.85 | CNR1 (0.32) | — | |
| SCHEMBL16962555 | 0.83 | GABRA1 (0.34) | IDH1KDM4EMAPK1GABRA1GABRB2 | |
| SCHEMBL16951190 | 0.82 | NPC1 (0.41) | MAPK1PTGS2 | |
| SCHEMBL16955867 | 0.81 | RXRA (0.36) | PTGS2 | |
| SCHEMBL16959033 | 0.81 | GABRA1 (0.38) | IDH1KDM4EMAPK1GABRA1GABRB2 | |
| SCHEMBL23625173 | 0.81 | TYR (0.45) | IDH1KDM4EMAPK1PTGS2AKR1C3 | |
| SCHEMBL9734683 | 0.79 | PTGS2 (0.36) | IDH1MAPK1GABRA1GABRB2PTGS2 | |
| SCHEMBL14606816 | 0.79 | PTGS2 (0.36) | IDH1MAPK1GABRA1GABRB2PTGS2 | |
| SCHEMBL19314112 | 0.78 | PTGS2 (0.32) | PTGS2 | |
| SCHEMBL13883381 | 0.78 | KDM4E (0.56) | KDM4EMAPK1PTGS2AKR1C3AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |