Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.34 |
| ▸ | UCHL3 | P15374 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16961704 | 0.90 | CNR1 (0.32) | — | |
| SCHEMBL16957595 | 0.84 | HPGD (0.50) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL16958428 | 0.83 | NPC1 (0.37) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL16952798 | 0.82 | IDH1 (0.31) | MAPK1PTGS2 | |
| SCHEMBL27947527 | 0.82 | HPGD (0.47) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL5512923 | 0.82 | HPGD (0.47) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL16957769 | 0.80 | HPGD (0.47) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL16961878 | 0.80 | NPC1 (0.41) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL16953284 | 0.79 | HPGD (0.46) | NPC1RAB9AHPGDMAPK1HTT | |
| SCHEMBL16962555 | 0.77 | GABRA1 (0.34) | NPC1RAB9AMAPK1PTGS2SMN1; SMN2 |
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 |