Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16958560 | 0.90 | CNR1 (0.41) | KDM4EALDH1A1SMN1; SMN2CNR1CNR2 | |
| SCHEMBL16953237 | 0.87 | CNR1 (0.42) | CNR1CNR2AHRPPARG | |
| SCHEMBL16956805 | 0.86 | SMN1; SMN2 (0.41) | KDM4EALDH1A1SMN1; SMN2CHRM2CHRM1 | |
| SCHEMBL16951828 | 0.84 | PTGS2 (0.47) | CNR1CNR2ESR1AHRCALM1 | |
| SCHEMBL16955644 | 0.84 | KMT2A (0.35) | CNR1CNR2 | |
| SCHEMBL16954674 | 0.83 | ESR1 (0.47) | KDM4EALDH1A1SMN1; SMN2ESR1AHR | |
| SCHEMBL16958100 | 0.83 | CHRM2 (0.36) | KDM4EALDH1A1SMN1; SMN2CNR1CNR2 | |
| SCHEMBL16955630 | 0.81 | CNR1 (0.39) | ALDH1A1CNR1CNR2GPR84THRB | |
| SCHEMBL16958515 | 0.80 | CNR1 (0.43) | ALDH1A1SMN1; SMN2CNR1CNR2AHR | |
| SCHEMBL16959735 | 0.80 | KDM4E (0.37) | KDM4EALDH1A1SMN1; SMN2CHRM2CHRM1 |
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 |