Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.57 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 9/20 | 0.42 |
| ▸ | CNR2 | P34972 | 7/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16951828 | 0.90 | PTGS2 (0.47) | PTGS2AHRCNR1CNR2CALM1 | |
| SCHEMBL16958515 | 0.85 | CNR1 (0.43) | PTGS2AHRCNR1CNR2NPC1 | |
| SCHEMBL16958560 | 0.85 | CNR1 (0.41) | PTGS2CNR1CNR2NPC1HPGD | |
| SCHEMBL16957595 | 0.84 | HPGD (0.50) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL16951086 | 0.83 | PTGS2 (0.53) | PTGS2AHRCNR1CNR2NPC1 | |
| SCHEMBL16951774 | 0.82 | CYP1A1 (0.43) | PTGS2AHRNPC1MAPK1RAB9A | |
| SCHEMBL9279920 | 0.82 | PTGS2 (0.67) | PTGS2AHRCNR1CNR2NPC1 | |
| SCHEMBL16954729 | 0.81 | PTGS2 (0.38) | PTGS2CNR1CNR2NPC1HPGD | |
| SCHEMBL16952311 | 0.81 | PTGS2 (0.38) | PTGS2CNR1CNR2NPC1HPGD | |
| SCHEMBL16952425 | 0.81 | ALOX5 (0.44) | PTGS2NPC1HPGDMAPK1HTT |
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 |