Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | PDE5A | O76074 | 9/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 5/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | ADK | P55263 | 1/20 | 0.34 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8537029 | 0.81 | ADRA1A (0.50) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8614544 | 0.80 | ADRA1A (0.49) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8536843 | 0.80 | ADRA1A (0.49) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8615627 | 0.77 | ADRA1A (0.53) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8541667 | 0.76 | ADRA1A (0.52) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8538145 | 0.76 | ADRA1A (0.52) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8541523 | 0.75 | ADRA1A (0.54) | ADRA1APDE5APDE4APDE4BPDE4C | |
| SCHEMBL8536434 | 0.75 | ADRA1A (0.54) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL8535617 | 0.75 | ADRA1A (0.51) | ADRA1APDE5AIDO1PDE4APDE4B | |
| SCHEMBL3403159 | 0.73 | ADRA1A (0.58) | ADRA1APDE5APDE4APDE4BPDE4C |
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-0857171-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-08-12 | — | — | EP | disclosed |
| WO-1997015555-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-05-01 | — | — | WO | disclosed |