Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | AADAC | P22760 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16957279 | 0.89 | PTPN1 (0.35) | AKR1C3AKR1C2CYP3A4CYP1A2PTPN1 | |
| SCHEMBL16958791 | 0.84 | AR (0.39) | ALDH1A1CYP3A4ARSMN1; SMN2HTT | |
| SCHEMBL16955366 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP3A4SMN1; SMN2HTTALOX15 | |
| SCHEMBL16955955 | 0.81 | ADRB2 (0.35) | ALDH1A1CYP3A4ARSMN1; SMN2HTT | |
| SCHEMBL16958385 | 0.79 | PDE2A (0.39) | — | |
| SCHEMBL16950538 | 0.78 | APP (0.40) | ALDH1A1CYP3A4ARSMN1; SMN2HTT | |
| SCHEMBL16952720 | 0.78 | AR (0.46) | AKR1C3AKR1C2ALDH1A1CYP3A4AR | |
| SCHEMBL16952376 | 0.78 | MAPT (0.50) | ALDH1A1SMN1; SMN2LMNAMAPK1KMT2A | |
| SCHEMBL16956606 | 0.76 | TDP1 (0.37) | AKR1C3AKR1C2ALDH1A1CYP3A4AR | |
| SCHEMBL16959157 | 0.76 | PDE2A (0.40) | — |
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 |