Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.30 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.30 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.30 |
| ▸ | ALB | P02768 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL16960173 | 0.86 | GABRA1 (0.39) | GABRA1GABRB2PTGS1PTGS2NPC1 | |
| SCHEMBL2623872 | 0.80 | IDO1 (0.41) | GABRA1GABRB2MAOAMAOBPTGS1 | |
| SCHEMBL16956048 | 0.79 | GABRA1 (0.35) | GABRA1GABRB2PTGS1PTGS2NPC1 | |
| SCHEMBL16952999 | 0.79 | GABRA1 (0.35) | GABRA1GABRB2PTGS1PTGS2NPC1 | |
| SCHEMBL16961325 | 0.79 | PTGS2 (0.34) | PTGS1PTGS2TRPA1LMNAALOX5 | |
| SCHEMBL16960726 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2PTGS1PTGS2NPC1 | |
| SCHEMBL16952794 | 0.78 | MAOB (0.35) | GABRA1GABRB2MAOAMAOBNPC1 | |
| SCHEMBL16962582 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2PTGS1PTGS2NPC1 | |
| SCHEMBL16962555 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2PTGS1PTGS2NPC1 | |
| SCHEMBL16955179 | 0.77 | HTR2A (0.39) | GABRA1GABRB2NPC1RAB9ALMNA |
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 |