Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 16/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.54 |
| ▸ | PPARG | P37231 | 3/20 | 0.54 |
| ▸ | PPARD | Q03181 | 3/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6820864 | 0.79 | CDK1 (0.76) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL8936789 | 0.78 | ADORA3 (0.57) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL5193584 | 0.77 | CDK1 (0.61) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL5196107 | 0.77 | CDK1 (0.64) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL24615063 | 0.75 | ADORA3 (0.56) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL448405 | 0.74 | CDK1 (0.74) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL935056 | 0.72 | ADORA3 (0.78) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL935807 | 0.72 | ADORA3 (0.78) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL29464001 | 0.72 | ADORA3 (0.78) | ADORA3ADORA1ADORA2APPARGPPARD | |
| SCHEMBL1661030 | 0.72 | ADORA3 (0.78) | ADORA3ADORA1ADORA2APPARGPPARD |
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-2015009008-A1 | NOVEL ADENINE DERIVATIVE AND USE THEREOF | 고려대학교산학협력단 (KR) | 2015-01-22 | — | — | WO | disclosed |