Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | GPR3 | P46089 | 5/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 5/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16955166 | 0.83 | GPR3 (0.39) | PDE2AGPR3KIF11CES1NPC1 | |
| SCHEMBL16957164 | 0.82 | GPR3 (0.38) | PDE2AGPR3KIF11CES1NPC1 | |
| SCHEMBL16959893 | 0.81 | PDE2A (0.49) | PDE2AGPR3FFAR4FFAR1TRPA1 | |
| SCHEMBL16952131 | 0.79 | CHRM2 (0.40) | CYP1A2TP53CYP3A4ALOX15BLM | |
| SCHEMBL16955353 | 0.78 | PDE2A (0.38) | PDE2AGPR3CES1SLC6A2 | |
| SCHEMBL16950375 | 0.78 | FFAR4 (0.41) | PDE2AGPR3FFAR4FFAR1GAA | |
| SCHEMBL12263421 | 0.77 | PDE2A (0.51) | PDE2AGPR3FFAR4FFAR1TRPA1 | |
| SCHEMBL16954856 | 0.77 | NQO1 (0.42) | FFAR4FFAR1SYKNPC1RAB9A | |
| SCHEMBL16954190 | 0.76 | MEN1 (0.37) | PDE2AGPR3CES1CYP1A2LMNA | |
| SCHEMBL24180111 | 0.75 | PDE2A (0.49) | PDE2AGPR3FFAR4FFAR1TRPA1 |
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 |