Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 5/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL518353 | 0.78 | GPR3 (0.46) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL30377217 | 0.78 | GPR3 (0.46) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL901106 | 0.78 | GPR3 (0.46) | GPR3CES1GAAKIF11NPC1 | |
| SCHEMBL2043198 | 0.78 | GPR3 (0.46) | GPR3CES1GAAKIF11NPC1 | |
| SCHEMBL1034163 | 0.76 | GPR3 (0.44) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL1221631 | 0.76 | GPR3 (0.45) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL3711415 | 0.76 | WDR5 (0.44) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL29758243 | 0.76 | GPR3 (0.44) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL29427162 | 0.76 | GPR3 (0.45) | GPR3CES1GAAALDH1A1POLB | |
| SCHEMBL3750038 | 0.76 | GPR3 (0.44) | GPR3CES1GAAALDH1A1POLB |
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 |