Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | PTGIR | P43119 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 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 | |
|---|---|---|---|---|
| SCHEMBL3211200 | 0.83 | SMYD2 (0.57) | SMYD2GPR52DRD4 | |
| SCHEMBL1850827 | 0.80 | SMYD2 (0.54) | SMYD2GPR52DRD4 | |
| SCHEMBL1849693 | 0.78 | GPR52 (0.52) | GPR52 | |
| SCHEMBL1855790 | 0.74 | GPR52 (0.45) | ALDH1A1HPGDGPR52 | |
| SCHEMBL1851120 | 0.73 | GPR52 (0.53) | ALDH1A1SMYD2GPR52DRD4 | |
| SCHEMBL1849845 | 0.72 | GPR52 (0.44) | ALDH1A1HPGDKDM4EGPR52 | |
| SCHEMBL1855327 | 0.71 | GPR52 (0.51) | ALDH1A1GPR52DRD4 | |
| SCHEMBL7959088 | 0.70 | TAS1R3 (0.53) | HPGDGPR52 | |
| SCHEMBL1850921 | 0.68 | GPR52 (0.49) | ALDH1A1HPGDGPR52ROCK2ROCK1 | |
| SCHEMBL3209922 | 0.67 | GPR52 (0.49) | HPGDKDM4EGPR52 |
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-2323978-A1 | AMIDE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2011-05-25 | — | — | EP | disclosed |
| WO-2010018874-A1 | AMIDE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-02-18 | — | — | WO | disclosed |