Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 5/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | PRCP | P42785 | 1/20 | 0.35 |
| ▸ | EBP | Q15125 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16957390 | 0.97 | HDAC4 (0.46) | HDAC4HDAC2HDAC8KMODRD3 | |
| SCHEMBL16959998 | 0.93 | HDAC4 (0.38) | HDAC4HDAC2HDAC8KMODRD2 | |
| SCHEMBL16951471 | 0.83 | HDAC4 (0.39) | HDAC4HDAC2HDAC8KMODRD3 | |
| SCHEMBL16961080 | 0.80 | HDAC4 (0.42) | HDAC4HDAC2HDAC8KMODRD3 | |
| SCHEMBL16960705 | 0.79 | HDAC4 (0.41) | HDAC4HDAC2HDAC8KMODRD3 | |
| SCHEMBL16959890 | 0.78 | ESR2 (0.33) | ESR1ESR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL16957736 | 0.78 | HDAC4 (0.40) | HDAC4HDAC2HDAC8KMODRD3 | |
| SCHEMBL16957285 | 0.76 | HDAC4 (0.45) | HDAC4HDAC2HDAC8KMODRD3 | |
| SCHEMBL30988811 | 0.76 | SLC18A3 (0.44) | HDAC4HDAC2HDAC8KMODRD2 | |
| SCHEMBL30988828 | 0.76 | SLC18A3 (0.44) | HDAC4HDAC2HDAC8KMODRD2 |
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 |