Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 7/20 | 0.55 |
| ▸ | DRD2 | P14416 | 5/20 | 0.52 |
| ▸ | DRD4 | P21917 | 5/20 | 0.52 |
| ▸ | DRD3 | P35462 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP4 | P49662 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18757008 | 0.91 | AOC3 (0.59) | AOC3DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL12526352 | 0.87 | AOC3 (0.47) | AOC3DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL17703740 | 0.86 | AOC3 (0.55) | AOC3DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL16784922 | 0.82 | AOC3 (0.49) | AOC3DRD2DRD4DRD3HDAC6 | |
| SCHEMBL16785169 | 0.81 | AOC3 (0.50) | AOC3DRD2DRD4DRD3BCL2L1 | |
| SCHEMBL17656753 | 0.79 | ITGB3 (0.63) | DRD2DRD4DRD3TSHRHDAC4 | |
| SCHEMBL12526638 | 0.79 | AOC3 (0.49) | AOC3DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL17656757 | 0.78 | AOC3 (0.48) | AOC3DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL12525675 | 0.78 | AOC3 (0.60) | AOC3DRD2DRD4DRD3 | |
| SCHEMBL17703745 | 0.77 | HDAC6 (0.46) | AOC3DRD2DRD4DRD3ALDH1A1 |
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-3002278-A1 | GUANIDINE COMPOUND | Astellas Pharma Inc. (JP) | 2016-04-06 | — | — | EP | disclosed |