Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 4/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10747744 | 0.99 | CYP2D6 (0.49) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| Hydrochloric Acid SCHEMBL10753728 | 0.86 | CYP2D6 (0.48) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| SCHEMBL5155642 | 0.85 | ADRA1A (0.52) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| Hydrochloric Acid SCHEMBL10754434 | 0.84 | MEN1 (0.52) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| SCHEMBL9814125 | 0.83 | ADRA1A (0.48) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| Hydrochloric Acid SCHEMBL10749229 | 0.82 | CYP2D6 (0.49) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| SCHEMBL2776285 | 0.81 | ADRA1A (0.54) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| Hydrochloric Acid SCHEMBL10749865 | 0.80 | CYP2D6 (0.59) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 | |
| SCHEMBL9814117 | 0.80 | ADRA1A (0.62) | ADRA1AADRA2AHTR1AOPRM1MEN1 | |
| Hydrochloric Acid SCHEMBL10752155 | 0.79 | CYP2D6 (0.41) | ADRA1AADRA2ACYP2D6HTR1AOPRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0166937-B1 | ADRENERGIC COMPOUNDS | ABBOTT LABORATORIES (US) | 1991-08-28 | — | — | EP | disclosed |