Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 12/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 11/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 11/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.36 |
| ▸ | MTOR | P42345 | 3/20 | 0.34 |
| ▸ | RPTOR | Q8N122 | 3/20 | 0.34 |
| ▸ | MLST8 | Q9BVC4 | 3/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL7968307 | 0.89 | ADRA1A (0.39) | ADRA1AADRA1DADRA1BADAM17MTOR | |
| SCHEMBL7954991 | 0.78 | ADRA1D (0.39) | ADRA1AADRA1DADRA1BADAM17MTOR | |
| SCHEMBL7954985 | 0.78 | ADRA1D (0.39) | ADRA1AADRA1DADRA1BADAM17MTOR | |
| SCHEMBL13651261 | 0.76 | ADRA1A (0.46) | ADRA1AADRA1DADRA1BKDM1A | |
| SCHEMBL7842959 | 0.75 | ADRA1D (0.44) | ADRA1AADRA1DADRA1BADAM17DPP4 | |
| SCHEMBL7968309 | 0.75 | ADRA1D (0.40) | ADRA1AADRA1DADRA1BADAM17MTOR | |
| SCHEMBL7968302 | 0.75 | ADRA1D (0.40) | ADRA1AADRA1DADRA1BADAM17MTOR | |
| Trifluoroacetic Acid SCHEMBL7967514 | 0.73 | ADRA1D (0.38) | ADRA1AADRA1DADRA1BADAM17MTOR | |
| SCHEMBL7955554 | 0.68 | ADRA1D (0.52) | ADRA1AADRA1DADRA1B | |
| SCHEMBL6965559 | 0.68 | ADRA1D (0.52) | ADRA1AADRA1DADRA1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1003512-A1 | ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2000-05-31 | — | — | EP | disclosed |
| WO-1998057642-A1 | ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1998-12-23 | — | — | WO | disclosed |