Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 5/20 | 0.34 |
| ▸ | CNR2 | P34972 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.31 |
| ▸ | PGK1 | P00558 | 1/20 | 0.31 |
| ▸ | PGK2 | P07205 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | LPL | P06858 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16957916 | 0.89 | NPC1 (0.48) | HTTHPGDNPC1MAPK1RAB9A | |
| SCHEMBL16955630 | 0.87 | CNR1 (0.39) | CNR1CNR2HTTHPGDNPC1 | |
| SCHEMBL16952580 | 0.83 | PTGS2 (0.39) | PTGS2PGK1PGK2TRPA1 | |
| SCHEMBL16957076 | 0.82 | CNR1 (0.35) | CNR1CNR2HTTHPGDNPC1 | |
| SCHEMBL16957769 | 0.80 | HPGD (0.47) | HTTHPGDNPC1MAPK1RAB9A | |
| SCHEMBL28027680 | 0.80 | FFAR4 (0.39) | FFAR4HTTHPGDNPC1MAPK1 | |
| SCHEMBL16958591 | 0.80 | TP53 (0.41) | FFAR4CNR1CNR2HTTHPGD | |
| SCHEMBL16950350 | 0.78 | CNR1 (0.33) | CNR1CNR2THRBPTGS2CYP3A4 | |
| SCHEMBL16955782 | 0.78 | CNR1 (0.33) | CNR1CNR2THRBALDH1A1PTGS2 | |
| SCHEMBL16952299 | 0.78 | CNR2 (0.35) | CNR1CNR2HTTTHRBALDH1A1 |
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 |