Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 5/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.45 |
| ▸ | DRD3 | P35462 | 6/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 4/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | VDR | P11473 | 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 | |
|---|---|---|---|---|
| SCHEMBL6210045 | 0.90 | DPP4 (0.46) | HDAC3HDAC1HDAC8 | |
| SCHEMBL6209065 | 0.89 | HDAC1 (0.43) | HDAC3HDAC1DRD3HTR1AHTR2A | |
| SCHEMBL6211873 | 0.89 | CTSK (0.39) | HDAC3HDAC1HDAC8 | |
| SCHEMBL6210990 | 0.87 | DPP4 (0.38) | DRD3DRD2DRD4 | |
| SCHEMBL6255781 | 0.87 | DPP4 (0.47) | HDAC3HDAC1DRD3DRD4VDR | |
| SCHEMBL6211807 | 0.86 | DPP4 (0.42) | DRD3DRD2 | |
| SCHEMBL6210146 | 0.84 | CHRM2 (0.41) | HDAC3HDAC1DRD3DRD2 | |
| SCHEMBL6213978 | 0.83 | CASR (0.38) | — | |
| SCHEMBL6210861 | 0.83 | HDAC1 (0.41) | HDAC3HDAC1DRD3HTR1AHTR2A | |
| SCHEMBL6211482 | 0.83 | HDAC3 (0.40) | HDAC3HDAC1DRD3DRD2HDAC8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1546150-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | Amura Therapeutics Limited (GB) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004007501-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | AMURA THERAPEUTICS LIMITED (GB) | 2004-01-22 | — | — | WO | disclosed |