Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1986986 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP3A4MAPK1NPC1 | |
| SCHEMBL27341362 | 0.83 | ALDH1A1 (0.43) | ALDH1A1HPGDCYP3A4MAPK1NPC1 | |
| SCHEMBL16956027 | 0.80 | NPC1 (0.44) | ALDH1A1HPGDCYP3A4MAPK1NPC1 | |
| SCHEMBL11694926 | 0.79 | SMN1; SMN2 (0.61) | ALDH1A1HPGDNPC1RAB9AMEN1 | |
| SCHEMBL29694578 | 0.79 | SMN1; SMN2 (0.61) | ALDH1A1HPGDNPC1RAB9AMEN1 | |
| SCHEMBL13362708 | 0.79 | HTT (0.44) | ALDH1A1HPGDCYP3A4MAPK1NPC1 | |
| SCHEMBL16961187 | 0.79 | NPC1 (0.40) | ALDH1A1HPGDCYP3A4MAPK1NPC1 | |
| SCHEMBL17384919 | 0.79 | NR1I2 (0.48) | ALDH1A1HPGDCYP3A4MAPK1NPC1 | |
| SCHEMBL16962139 | 0.78 | MAPT (0.61) | ALDH1A1HPGDRAB9AMEN1KMT2A | |
| SCHEMBL2855495 | 0.78 | KDM4E (0.55) | ALDH1A1HPGDCYP3A4MAPK1NPC1 |
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 |