Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.30 |
| ▸ | PIK3CG | P48736 | 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 | |
|---|---|---|---|---|
| SCHEMBL9864870 | 0.72 | CYP2A6 (0.30) | — | |
| SCHEMBL9864602 | 0.70 | KEAP1 (0.35) | — | |
| SCHEMBL3716774 | 0.69 | GRIA2 (0.39) | PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL9865184 | 0.63 | USP7 (0.39) | — | |
| SCHEMBL10051874 | 0.59 | EPAS1 (0.55) | PTGS2PTGS1 | |
| SCHEMBL10745651 | 0.58 | VCAM1 (0.38) | — | |
| SCHEMBL9865123 | 0.57 | KEAP1 (0.35) | — | |
| SCHEMBL19105511 | 0.57 | PTGDR2 (0.44) | PTGS2 | |
| SCHEMBL9864883 | 0.57 | — | — | |
| SCHEMBL15228357 | 0.56 | PIK3CD (0.44) | PIK3CDPIK3CAPIK3CBPIK3CG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4994485-A | Seed and soil fungi, bacteria | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1991-02-19 | — | — | US | disclosed |
| EP-0234622-B1 | NEW THIO COMPOUNDS HAVING FUNGICIDAL ACTIVITY | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1990-06-27 | — | — | EP | disclosed |
| EP-0234622-A1 | New thio compounds having fungicidal activity | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1987-09-02 | — | — | EP | disclosed |