Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 7/20 | 0.38 |
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 4/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | GPX4 | P36969 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10808743 | 0.87 | TP53 (0.54) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL11698654 | 0.79 | TP53 (0.64) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL6902093 | 0.79 | TP53 (0.59) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL10873205 | 0.79 | TP53 (0.63) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL10892576 | 0.79 | ALDH1A1 (0.58) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL9614029 | 0.77 | TP53 (0.71) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL27976189 | 0.76 | TP53 (0.69) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL10872220 | 0.75 | TP53 (0.59) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL6446793 | 0.75 | TP53 (0.55) | TP53ALDH1A1TDP1NR1I2CYP3A4 | |
| SCHEMBL11102927 | 0.75 | TP53 (0.68) | TP53ALDH1A1TDP1NR1I2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1372395-A1 | HERBICIDES BASED ON SUBSTITUTED ARYL KETONES | Bayer CropScience AG (DE) | 2004-01-02 | — | — | EP | claimed |
| WO-2002071845-A1 | HERBICIDES BASED ON SUBSTITUTED ARYL KETONES | BAYER CROPSCIENCE AG (DE) | 2002-09-19 | — | — | WO | claimed |