Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 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 | |
|---|---|---|---|---|
| SCHEMBL16955782 | 0.89 | CNR1 (0.33) | PTGS2CYP3A4TRPV1ALDH1A1GAA | |
| SCHEMBL16957595 | 0.87 | HPGD (0.50) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL16957769 | 0.83 | HPGD (0.47) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL16960722 | 0.82 | NPC1 (0.39) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL3232455 | 0.82 | HPGD (0.39) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL16953284 | 0.81 | HPGD (0.46) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL16961325 | 0.81 | PTGS2 (0.34) | PTGS2 | |
| SCHEMBL4197444 | 0.80 | NPC1 (0.50) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL16957916 | 0.80 | NPC1 (0.48) | HPGDHTTNPC1MAPK1RAB9A | |
| SCHEMBL16958961 | 0.79 | HPGD (0.43) | HPGDHTTNPC1MAPK1RAB9A |
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 |