Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 8/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.52 |
| ▸ | HRH1 | P35367 | 5/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5661329 | 1.00 | ADRA1A (0.52) | ADRA1AADRA1DADRA1BHRH1ADRA2A | |
| SCHEMBL8004288 | 1.00 | ADRA1A (0.52) | ADRA1AADRA1DADRA1BHRH1ADRA2A | |
| SCHEMBL3342133 | 0.85 | LMNA (0.58) | ADRA1AADRA1DADRA1BHRH1ADRA2A | |
| SCHEMBL17478253 | 0.82 | RPS6KB1 (0.55) | LMNAHTTGPBAR1TP53 | |
| SCHEMBL3888823 | 0.82 | GPBAR1 (0.65) | LMNAHTTGPBAR1TP53 | |
| SCHEMBL14587508 | 0.81 | GPBAR1 (0.76) | ADRA1AADRA1DADRA1BHRH1ADRA2A | |
| SCHEMBL7669646 | 0.80 | ADRA1A (0.42) | ADRA1AADRA1DADRA1BHRH1ADRA2A | |
| SCHEMBL7686416 | 0.80 | ADRA1A (0.42) | ADRA1AADRA1DADRA1BHRH1ADRA2A | |
| SCHEMBL4312703 | 0.80 | RPS6KB1 (0.58) | LMNAHTTGPBAR1TP53 | |
| SCHEMBL14619732 | 0.79 | ADRA1D (0.51) | ADRA1AADRA1DADRA1BHRH1ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000025782-A1 | DIHYDROPYRIDINONES AND PYRROLINONES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | claimed |
| US-6235759-B1 | BENIGN PROSTATIC HYPERPLASIA; HYPOTENSIVE AGENTS | MERCK & CO., INC. | 2001-05-22 | — | — | US | disclosed |
| WO-2000025782-A1 | DIHYDROPYRIDINONES AND PYRROLINONES USEFUL AS ALPHA 1A ADRENOCEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | disclosed |