Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.49 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.41 |
| ▸ | TLR4 | O00206 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16959787 | 0.91 | AHR (0.50) | AHRPLA2G2ALTA4HNR5A1TLR4 | |
| SCHEMBL16954674 | 0.89 | ESR1 (0.47) | AHRESR1ALDH1A1KDM4ELTA4H | |
| SCHEMBL16961616 | 0.84 | AHR (0.44) | AHRPLA2G2ALTA4HNR5A1TLR4 | |
| SCHEMBL16953908 | 0.83 | AHR (0.44) | AHRPLA2G2AALDH1A1KDM4ELTA4H | |
| SCHEMBL16960150 | 0.83 | AHR (0.43) | AHRPLA2G2AALDH1A1KDM4ELTA4H | |
| SCHEMBL16959224 | 0.83 | AHR (0.43) | AHRPLA2G2AALDH1A1LTA4HSMN1; SMN2 | |
| SCHEMBL16960271 | 0.83 | AHR (0.43) | AHRPLA2G2AALDH1A1KDM4ELTA4H | |
| SCHEMBL16956779 | 0.83 | AHR (0.43) | AHRPLA2G2ALTA4HNR5A1TLR4 | |
| SCHEMBL16959200 | 0.83 | AHR (0.43) | AHRPLA2G2ALTA4HNR5A1TLR4 | |
| SCHEMBL16962163 | 0.82 | AHR (0.47) | AHRPLA2G2AALDH1A1KDM4ELTA4H |
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 |