Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4766007 | 0.91 | C5AR1 (0.41) | ADORA2AADORA2BADORA1C5AR1 | |
| SCHEMBL4769541 | 0.88 | MAPT (0.37) | ALDH1A1ADORA2AADORA2BADORA1MAPT | |
| SCHEMBL4765722 | 0.88 | TP53 (0.41) | TP53TSHRALDH1A1ADORA2AADORA2B | |
| SCHEMBL4769532 | 0.88 | MAPT (0.37) | ALDH1A1ADORA2AADORA2BADORA1MAPT | |
| SCHEMBL4765708 | 0.88 | TP53 (0.41) | TP53TSHRALDH1A1ADORA2AADORA2B | |
| SCHEMBL4771507 | 0.86 | MAPT (0.36) | NPSR1ALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL4867818 | 0.85 | ADORA2B (0.39) | TP53TSHRNPSR1ALDH1A1POLB | |
| SCHEMBL4792629 | 0.84 | SMN1; SMN2 (0.35) | TSHRNPSR1ALDH1A1POLBMAPT | |
| SCHEMBL4763924 | 0.84 | NPSR1 (0.33) | TSHRNPSR1ALDH1A1POLBADORA2A | |
| SCHEMBL4763921 | 0.84 | NPSR1 (0.33) | TSHRNPSR1ALDH1A1POLBADORA2A |
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-1678181-B1 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS INC (US) | 2008-12-31 | — | — | EP | disclosed |