Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.54 |
| ▸ | CCR2 | P41597 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | CCR3 | P51677 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.49 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4855546 | 0.89 | HRH3 (0.74) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL8393625 | 0.84 | HRH3 (0.71) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL3022526 | 0.84 | HRH3 (0.71) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL4125911 | 0.82 | HRH3 (0.65) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL5203366 | 0.82 | HRH3 (0.69) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL10605326 | 0.82 | HRH3 (0.69) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL13450155 | 0.82 | SMN1; SMN2 (0.71) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL4227981 | 0.82 | HRH3 (1.00) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| Hydrochloric Acid SCHEMBL10605533 | 0.81 | SMN1; SMN2 (0.70) | HRH3SMN1; SMN2GAAOPRK1ROCK1 | |
| SCHEMBL13463052 | 0.81 | HRH3 (0.70) | HRH3SMN1; SMN2GAAOPRK1ROCK1 |
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-2493571-A1 | ALKYNYL DERIVATIVES USEFUL AS DPP-1 INHIBITORS | Janssen Pharmaceutica, N.V. (BE) | 2012-09-05 | — | — | EP | disclosed |
| WO-2011059731-A1 | ALKYNYL DERIVATIVES USEFUL AS DPP-1 INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-05-19 | — | — | WO | disclosed |