Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 9/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19467090 | 0.86 | NPSR1 (0.54) | IRAK4DGAT1TGFBR1DPP4NPSR1 | |
| SCHEMBL15254459 | 0.83 | GPR119 (0.44) | HRH3DGAT1GPR119DPP4AAK1 | |
| SCHEMBL21765953 | 0.82 | IRAK4 (0.50) | IRAK4CREBBPTGFBR1NPSR1 | |
| SCHEMBL15254312 | 0.80 | DPP4 (0.47) | GPR119DPP4AAK1 | |
| SCHEMBL15254714 | 0.79 | FYN (0.46) | GPR119DPP4AAK1 | |
| Hydrochloric Acid SCHEMBL15254786 | 0.79 | DPP4 (0.46) | GPR119DPP4AAK1 | |
| SCHEMBL19467189 | 0.79 | AAK1 (0.47) | DGAT1GPR119DPP4AAK1 | |
| Hydrochloric Acid SCHEMBL15254713 | 0.78 | FYN (0.45) | GPR119DPP4AAK1 | |
| SCHEMBL15254978 | 0.78 | AAK1 (0.52) | GPR119DPP4AAK1NPSR1 | |
| SCHEMBL15254274 | 0.78 | AAK1 (0.51) | HRH3DGAT1GPR119DPP4AAK1 |
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-2822555-B1 | INHIBITION OF ADAPTOR ASSOCIATED KINASE 1 FOR THE TREATMENT OF PAIN | LEXICON PHARMACEUTICALS INC (US) | 2017-11-08 | — | — | EP | disclosed |
| EP-3235499-A2 | INHIBITION OF ADAPTOR ASSOCIATED KINASE 1 FOR THE TREATMENT OF PAIN | Lexicon Pharmaceuticals, Inc. (US) | 2017-10-25 | — | — | EP | disclosed |