Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 4/20 | 0.68 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.68 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.68 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.68 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.68 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9535559 | 0.87 | ADRA2A (0.64) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL9533257 | 0.85 | ADRA2A (0.57) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL9535620 | 0.85 | ADRA2A (0.57) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL9535724 | 0.85 | ADRA2A (0.61) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL8605175 | 0.81 | ADRA2A (1.00) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL9533864 | 0.81 | ADRA2A (0.56) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL6661626 | 0.81 | ADRA2A (0.79) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL9377952 | 0.81 | ADRA2A (0.97) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL9535651 | 0.80 | ADRA1D (0.67) | ADRA1DADRA1AADRA1BADRA2AADRA2B | |
| SCHEMBL9379609 | 0.79 | ADRA2A (0.81) | ADRA1DADRA1AADRA1BADRA2AADRA2B |
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-0384677-B1 | Alpha-adrenergic receptor antagonists | SMITHKLINE BEECHAM CORP (US) | 1993-12-01 | — | — | EP | disclosed |
| US-4981848-A | CARDIOVASCULAR, HYPOTENSIVE, ANTIDEPRESSANT | SMITHKLINE BEECHAM CORPORATION (US) | 1991-01-01 | — | — | US | disclosed |
| EP-0384677-A1 | Alpha-adrenergic receptor antagonists | SMITHKLINE BEECHAM CORPORATION (US) | 1990-08-29 | — | — | EP | disclosed |