Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 7/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14042629 | 0.82 | NISCH (0.46) | NISCHADRA2AADRA2BADRA2CCYP2D6 | |
| SCHEMBL14042574 | 0.82 | LMNA (0.46) | NISCHADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL14042632 | 0.82 | LMNA (0.44) | NISCHADRA2AADRA2BADRA2CCYP2D6 | |
| SCHEMBL949042 | 0.80 | KDM4E (0.52) | NISCHADRA2ATAAR1ADRA2BADRA2C | |
| SCHEMBL4788507 | 0.80 | SLC6A2 (0.46) | NISCHADRA2ATAAR1ADRA2BADRA2C | |
| SCHEMBL14042630 | 0.80 | CYP2D6 (0.46) | NISCHADRA2AADRA2BADRA2CCYP2D6 | |
| Iodide SCHEMBL951481 | 0.79 | KDM4E (0.51) | NISCHADRA2ATAAR1ADRA2BADRA2C | |
| SCHEMBL4788240 | 0.78 | ADRA2A (0.44) | NISCHADRA2AADRA2BADRA2CCYP2D6 | |
| SCHEMBL14042571 | 0.76 | PTGIR (0.39) | NISCHADRA2AADRA2BADRA2CCYP2D6 | |
| SCHEMBL4788401 | 0.75 | KDM4E (0.44) | NISCHADRA2AADRA2BADRA2CCYP2D6 |
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-2008123821-A1 | 4, 5-DIHYDRO-LH-IMIDAZOL-2-AMINE DERIVATIVES FOR USE IN THE TREATMENT OF RESPIRATORY, CARDIOVASCULAR, NEUROLOGICAL OR GASTROINTESTINAL DISORDERS | ALBIREO AB (SE) | 2008-10-16 | — | — | WO | disclosed |