Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | ADK | P55263 | 1/20 | 0.47 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL11706961 | 0.81 | ADRA2A (0.38) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL1348889 | 0.80 | SLC6A2 (0.50) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL4729372 | 0.78 | MTOR (0.48) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL2205006 | 0.77 | F2RL1 (0.48) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL4363951 | 0.77 | MTOR (0.47) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL8700070 | 0.77 | MTOR (0.47) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL28000044 | 0.77 | ADRA2A (0.60) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL698729 | 0.77 | ADRA2A (0.60) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL953558 | 0.76 | ADRA2A (0.48) | MTORADKNISCHADRA2AADRA2C | |
| SCHEMBL9386046 | 0.74 | NISCH (0.44) | MTORADKNISCHADRA2AADRA2C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000075135-A1 | BIARYL INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2000-12-14 | — | — | WO | disclosed |