Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.57 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.57 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.57 |
| ▸ | HSP90B1 | P14625 | 3/20 | 0.57 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | AHCY | P23526 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | DOT1L | Q8TEK3 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11409693 | 1.00 | ADORA3 (0.57) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11417494 | 0.89 | ADORA2A (0.69) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11417476 | 0.89 | ADORA2A (0.69) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11135029 | 0.88 | AHCY (0.71) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11135017 | 0.88 | AHCY (0.71) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11413667 | 0.88 | ADORA2B (0.69) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL1000839 | 0.88 | ADORA2B (0.69) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11409572 | 0.86 | HSP90B1 (0.59) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11409588 | 0.86 | HSP90B1 (0.59) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 | |
| SCHEMBL11700554 | 0.86 | HSP90B1 (0.57) | ADORA3ADORA2AADORA2BADORA1HSP90AA1 |
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-4224438-A | CARDIOTONIC AGENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1980-09-23 | — | — | US | disclosed |