Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 11/20 | 0.45 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL8328228 | 0.85 | ADORA3 (0.44) | ADORA3TMIGD3TRPV1KDM4ECASP1 | |
| SCHEMBL8523478 | 0.83 | ADORA3 (0.43) | ADORA3 | |
| SCHEMBL8327956 | 0.80 | ADORA3 (0.49) | ADORA3TMIGD3TRPV1KDM4ECASP1 | |
| SCHEMBL7873236 | 0.73 | ADORA3 (0.40) | ADORA3TMIGD3TRPV1HSD17B10ALDH1A1 | |
| SCHEMBL7873250 | 0.73 | ADORA3 (0.37) | ADORA3TMIGD3TRPV1ALDH1A1TSHR | |
| SCHEMBL8523663 | 0.72 | ADORA3 (0.42) | ADORA3TRPV1 | |
| SCHEMBL8326446 | 0.70 | ADORA3 (0.46) | ADORA3TRPV1SIRT2SIRT1 | |
| SCHEMBL8326915 | 0.69 | ADORA3 (0.41) | ADORA3TMIGD3 | |
| SCHEMBL8323291 | 0.69 | ADORA3 (0.43) | ADORA3TRPV1 | |
| SCHEMBL8325678 | 0.69 | ADORA3 (0.42) | ADORA3TMIGD3TRPV1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0943615-A1 | 1,4-DIHYDROPYRIDINE DERIVATIVES | Nikken Chemicals Company, Limited (JP) | 1999-09-22 | — | — | EP | disclosed |