Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | HRH1 | P35367 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13267921 | 0.83 | HRH3 (0.34) | HRH3HRH4CYP3A4CYP2D6HRH1 | |
| SCHEMBL13247041 | 0.80 | ADRA2A (0.46) | HRH3HRH4CYP3A4CYP2D6HRH1 | |
| SCHEMBL10000116 | 0.76 | ADRA2A (0.40) | HRH3HRH4CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL10000109 | 0.74 | ADRA2A (0.35) | HRH3HRH4CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL700313 | 0.73 | ADRA2A (0.49) | HRH3HRH4CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL10316451 | 0.72 | ADRA2A (0.34) | HRH3HRH4CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL10000120 | 0.71 | ADRA2A (0.34) | HRH3HRH4CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL10000100 | 0.70 | ADRA2A (0.43) | CYP3A4CYP2D6CYP1A2CYP2C19ADRA2A | |
| SCHEMBL10000113 | 0.70 | HRH3 (0.41) | HRH3HRH4CYP3A4CYP2D6HRH1 | |
| SCHEMBL3068612 | 0.70 | HRH3 (0.43) | HRH3HRH4CYP3A4CYP2D6HRH1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2162450-B1 | ((BICYLICHETEROARYL) IMIDAZOLYL) METHYLHETEROARYL COMPOUNDS AS ADRENERGIC RECEPTOR AGONISTS | ALLERGAN INC (US) | 2015-02-25 | — | — | EP | disclosed |
| US-8383646-B2 | Therapeutic ((bicylicheteroaryl)imidazolyl) methylheteroaryl compounds | ALLERGAN, INC. (US) | 2013-02-26 | — | — | US | disclosed |
| US-8383646-B2 | Therapeutic ((bicylicheteroaryl)imidazolyl) methylheteroaryl compounds | ALLERGAN, INC. (US) | 2013-02-26 | — | — | US | disclosed |
| US-20100190823-A1 | Therapeutic ((Bicylicheteroaryl)Imidazolyl) Methylheteroaryl Compounds | ALLEGERGAN INC. (US) | 2010-07-29 | — | — | US | disclosed |
| WO-2008147786-A1 | ((BICYLICHETEROARYL) IMIDAZOLYL) METHYLHETEROARYL COMPOUNDS AS ADRENERGIC RECEPTOR AGONISTS | ALLERGAN, INC. (US) | 2008-12-04 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100190823-A1 | Therapeutic ((Bicylicheteroaryl)Imidazolyl) Methylheteroaryl Compounds | OAT, HMGCR, GOT2 | HRH3 472/4885HRH4 238/4885CYP3A4 1231/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.