Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.30 |
| ▸ | 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 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | RARB | P10826 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 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) | GABRA1GABRB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL25934642 | 0.80 | GABRA1 (0.39) | GABRA1GABRB2GABRB1HMGCRPTGS1 | |
| SCHEMBL16952999 | 0.79 | GABRA1 (0.35) | GABRA1GABRB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16956048 | 0.79 | GABRA1 (0.35) | GABRA1GABRB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16953195 | 0.79 | PTGS2 (0.32) | PTGS1PTGS2ALOX5 | |
| SCHEMBL16962555 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16952794 | 0.78 | MAOB (0.35) | GABRA1GABRB2GABRB1NPC1RAB9A | |
| SCHEMBL16952878 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16960726 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2GABRB1NPC1RAB9A | |
| SCHEMBL16958684 | 0.76 | GABRA1 (0.33) | GABRA1GABRB2NPC1RAB9ASMN1; SMN2 |
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 |