Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 9/20 | 0.80 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.80 |
| ▸ | ADRA1B | P35368 | 8/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7852948 | 0.86 | ADRA1D (1.00) | ADRA1DADRA1AADRA1BKCNH2 | |
| SCHEMBL7848678 | 0.83 | ADRA1D (1.00) | ADRA1DADRA1AADRA1BKCNH2 | |
| SCHEMBL7845026 | 0.82 | ADRA1D (0.78) | ADRA1DADRA1AADRA1B | |
| SCHEMBL7851129 | 0.80 | ADRA1D (0.75) | ADRA1DADRA1AADRA1B | |
| SCHEMBL7849708 | 0.77 | ADRA1D (0.65) | ADRA1DADRA1AADRA1BKCNH2 | |
| SCHEMBL8568967 | 0.73 | KCNH2 (0.79) | ADRA1DADRA1AADRA1BKCNH2 | |
| SCHEMBL9451723 | 0.72 | ADRA1D (1.00) | ADRA1DADRA1AADRA1BKCNH2 | |
| Hydrochloric Acid SCHEMBL8565725 | 0.72 | ADRA1D (0.98) | ADRA1DADRA1AADRA1BKCNH2 | |
| SCHEMBL7849561 | 0.71 | ADRA1D (0.44) | ADRA1DADRA1AADRA1B | |
| SCHEMBL8569268 | 0.71 | ADRA1D (0.70) | ADRA1DADRA1AADRA1BKCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0831824-A4 | ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 2001-05-02 | — | — | EP | disclosed |
| EP-0831824-A1 | ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-04-01 | — | — | EP | disclosed |
| WO-1996039140-A1 | ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1996-12-12 | — | — | WO | disclosed |