Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16959213 | 0.86 | CHRM2 (0.35) | PTGS2CHRM2CHRM1CHRM3CETP | |
| SCHEMBL16958830 | 0.85 | PTGS2 (0.35) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16955430 | 0.81 | PTGS2 (0.57) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16958560 | 0.80 | CNR1 (0.41) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16951250 | 0.80 | NPC1 (0.40) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16958515 | 0.80 | CNR1 (0.43) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16954730 | 0.80 | PTGS2 (0.41) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16952311 | 0.79 | PTGS2 (0.38) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16957595 | 0.79 | HPGD (0.50) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16961706 | 0.78 | CETP (0.33) | CHRM2CHRM1CHRM3CETP |
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 |