Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 6/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.44 |
| ▸ | DRD2 | P14416 | 5/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.44 |
| ▸ | DRD3 | P35462 | 5/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 2/20 | 0.43 |
| ▸ | ANPEP | P15144 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14005648 | 0.88 | DRD4 (0.51) | DRD4CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7347045 | 0.82 | ACE (0.56) | ACEMEN1KMT2AXIAP | |
| SCHEMBL12893387 | 0.81 | ACE (0.48) | ACE | |
| SCHEMBL4992795 | 0.80 | ANPEP (0.49) | DRD4DRD2ANPEP | |
| SCHEMBL2276278 | 0.80 | ANPEP (0.49) | DRD4DRD2ANPEP | |
| SCHEMBL5638597 | 0.80 | ANPEP (0.49) | DRD4DRD2ANPEP | |
| SCHEMBL13899160 | 0.80 | ACE (0.51) | MTNR1AACEXIAP | |
| Hydrochloric Acid SCHEMBL2279099 | 0.79 | ANPEP (0.50) | DRD4DRD2ANPEP | |
| SCHEMBL5014806 | 0.79 | ANPEP (0.42) | ANPEPALDH1A1HTR2A | |
| SCHEMBL199165 | 0.79 | PDPK1 (0.59) | ACE |
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 |
|---|---|---|---|---|---|---|---|
| US-7989441-B2 | Organic compounds | NOVARTIS AG (CH) | 2011-08-02 | — | — | US | disclosed |