Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | ADK | P55263 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5309674 | 0.76 | GSK3B (0.44) | NISCHMTORADKPDE3BPDE3A | |
| SCHEMBL6786065 | 0.76 | HSP90AA1 (0.48) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL14304159 | 0.74 | NISCH (0.46) | NISCHMTORADKPDE3BPDE3A | |
| SCHEMBL197279 | 0.74 | NISCH (0.54) | NISCHMTORADKPDE3BPDE3A | |
| SCHEMBL28581729 | 0.73 | NISCH (0.52) | NISCHMTORADKPDE3BPDE3A | |
| SCHEMBL30216772 | 0.73 | NISCH (0.52) | NISCHMTORADKPDE3BPDE3A | |
| SCHEMBL13279689 | 0.72 | NISCH (0.42) | NISCHMTORADKPDE3BPDE3A | |
| SCHEMBL11367252 | 0.71 | ADRA2A (0.44) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL2651969 | 0.70 | ALDH1A1 (0.59) | NISCHMTORADKALDH1A1MEN1 | |
| SCHEMBL27398489 | 0.70 | NISCH (0.47) | NISCHMTORADKPDE3BPDE3A |
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-2007045096-A1 | OLIGOHETEROAROMATIC LUMINISCENT ASSEMBLIES AS HIGH-AFFINITY DNA SEQUENCE-DIRECTED LIGANDS | UNIVERSITY OF SASKATCHEWAN (CA) | 2007-04-26 | — | — | WO | disclosed |