Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | UNG | P13051 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | FBP1 | P09467 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9333647 | 0.85 | TDP1 (0.52) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL29838039 | 0.83 | TDP1 (0.50) | TP53TDP1ALDH1A1UNGPTGS2 | |
| SCHEMBL16952227 | 0.83 | TP53 (0.55) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL4153267 | 0.83 | TDP1 (0.50) | TP53TDP1ALDH1A1UNGPTGS2 | |
| SCHEMBL16957555 | 0.80 | TP53 (0.47) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL16950907 | 0.79 | TP53 (0.46) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL28242748 | 0.78 | TDP1 (0.52) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL17529236 | 0.78 | TP53 (0.48) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL18717041 | 0.78 | TP53 (0.53) | TP53TDP1ALDH1A1TSHRUNG | |
| SCHEMBL28276247 | 0.77 | TP53 (0.44) | TP53TDP1ALDH1A1TSHRUNG |
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 |