Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.37 |
| ▸ | HBB | P68871 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15716233 | 0.84 | ALDH1A1 (0.46) | CHRNB2CHRNA4PPARDNQO1MEN1 | |
| SCHEMBL16955652 | 0.82 | PTGDR2 (0.40) | CHRNB2CHRNA4MEN1KMT2ANPC1 | |
| SCHEMBL16957258 | 0.79 | CHRNB2 (0.43) | CHRNB2CHRNA4PPARDNQO1MEN1 | |
| SCHEMBL16957262 | 0.77 | NQO1 (0.45) | CHRNB2CHRNA4PPARDNQO1MEN1 | |
| SCHEMBL16957550 | 0.76 | CHRNB2 (0.42) | CHRNB2CHRNA4PPARDNQO1NPC1 | |
| SCHEMBL16952301 | 0.76 | KDM4E (0.43) | CHRNB2CHRNA4PPARDNQO1MEN1 | |
| SCHEMBL31225273 | 0.76 | CHRNB2 (0.42) | CHRNB2CHRNA4PPARDNQO1NPC1 | |
| SCHEMBL16951245 | 0.76 | CHRNB2 (0.39) | CHRNB2CHRNA4PPARDNQO1MEN1 | |
| SCHEMBL16957548 | 0.75 | CHRNB2 (0.41) | CHRNB2CHRNA4PPARDNQO1TP53 | |
| SCHEMBL16956975 | 0.75 | CHRNB2 (0.41) | CHRNB2CHRNA4PPARDNQO1MEN1 |
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 |