Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7873283 | 0.94 | ADORA3 (0.40) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL7876031 | 0.93 | ADORA3 (0.39) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL7871349 | 0.93 | ADORA3 (0.38) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL7864153 | 0.90 | ADORA3 (0.39) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL8143535 | 0.90 | ADORA3 (0.40) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL7873273 | 0.89 | ADORA3 (0.39) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL7869551 | 0.89 | ADORA3 (0.39) | ADORA3MAPK1CYP3A4TMIGD3TRPV1 | |
| SCHEMBL7864225 | 0.87 | ADORA3 (0.41) | ADORA3MAPK1CYP3A4TMIGD3TSHR | |
| SCHEMBL8142233 | 0.87 | CACNA1C (0.39) | ADORA3MAPK1CYP3A4TMIGD3TSHR | |
| SCHEMBL8135837 | 0.87 | ADORA3 (0.34) | ADORA3MAPK1CYP3A4TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6306853-B1 | DICARBOXYLIC ESTER DERIVATIVES OF DIHYDROPYRIDINE COMPOUNDS | NIKKEN CHEMICALS CO., LTD. (JP) | 2001-10-23 | — | — | US | disclosed |
| EP-1055672-A1 | 1,4-DIHYDROPYRIDINE DERIVATIVES | Nikken Chemicals Company, Limited (JP) | 2000-11-29 | — | — | EP | disclosed |