Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5893893 | 0.69 | ADRB2 (0.42) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL7145434 | 0.66 | ADRA2A (0.61) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL1461292 | 0.63 | ADRA2A (0.68) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL9767993 | 0.63 | ADRA2A (0.68) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL5894212 | 0.62 | ADRB2 (0.42) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL29278698 | 0.62 | ADRA2A (0.66) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL4122825 | 0.60 | ADRB2 (0.50) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL6285400 | 0.60 | CYP3A4 (0.48) | ADRA1A | |
| SCHEMBL213222 | 0.59 | ADRA1A (0.40) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| Hydrochloric Acid SCHEMBL11692252 | 0.59 | ADRB2 (0.48) | ADRB2 |
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-1562892-A1 | NOVEL DIHYDROXY-METHYLPHENYL DERIVATIVES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 2005-08-17 | — | — | EP | disclosed |
| WO-2004046083-A1 | NOVEL DIHYDROXY-METHYLPHENYL DERIVATIVES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2004-06-03 | — | — | WO | disclosed |