Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 3/20 | 0.37 |
| ▸ | PDE2A | O00408 | 2/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.36 |
| ▸ | ATP4A | P20648 | 1/20 | 0.36 |
| ▸ | ATP4B | P51164 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | RHOC | P08134 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16962727 | 0.86 | LTA4H (0.38) | LTA4HNR5A1CYP3A4CYP2D6 | |
| SCHEMBL16952746 | 0.86 | RXRA (0.44) | L3MBTL1CYP1A1CYP1B1 | |
| SCHEMBL17056171 | 0.80 | FAAH (0.44) | FAAHPPARGPPARAPTGESALOX5 | |
| SCHEMBL16961044 | 0.80 | FAAH (0.41) | FAAHPPARGPPARAPTGESALOX5 | |
| SCHEMBL16958794 | 0.80 | TSHR (0.40) | FAAHL3MBTL1LTA4HNR5A1CYP3A4 | |
| SCHEMBL16953265 | 0.79 | NQO1 (0.45) | L3MBTL1LTA4HNR5A1CYP3A4CYP2D6 | |
| SCHEMBL16952665 | 0.79 | SCN9A (0.42) | PPARGPPARA | |
| SCHEMBL16951596 | 0.78 | CA12 (0.41) | LTA4HNR5A1CYP3A4CYP2D6 | |
| SCHEMBL16958467 | 0.78 | AHR (0.55) | LTA4HNR5A1ATP4AATP4BCHRNB2 | |
| SCHEMBL17056172 | 0.78 | SCN9A (0.47) | FAAHPPARGPPARAPTGESALOX5 |
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 |