Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 18/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3643934 | 0.93 | HRH3 (0.47) | HRH3CYP2D6NPC1ALDH1A1HPGD | |
| SCHEMBL3645508 | 0.90 | HRH3 (0.48) | HRH3CYP2D6HRH4 | |
| SCHEMBL4014451 | 0.86 | HRH3 (0.66) | HRH3CYP2D6 | |
| SCHEMBL3647741 | 0.79 | HRH3 (0.50) | HRH3CYP2D6NPC1ALDH1A1RAB9A | |
| SCHEMBL4015848 | 0.78 | HRH3 (0.64) | HRH3CYP2D6 | |
| SCHEMBL4020519 | 0.77 | HRH3 (0.61) | HRH3CYP2D6 | |
| SCHEMBL4015702 | 0.73 | HRH3 (0.66) | HRH3CYP2D6 | |
| SCHEMBL4021042 | 0.73 | HRH3 (0.53) | HRH3CYP2D6 | |
| SCHEMBL3805249 | 0.72 | HRH3 (0.50) | HRH3CYP2D6 | |
| SCHEMBL3643485 | 0.72 | RAB9A (0.36) | HRH3NPC1ALDH1A1HPGDRAB9A |
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-2183237-A1 | BENZOFURAN- AND BENZO[B]THIOPHENE-2-CARBOXYLIC ACID AMIDE DERIVATIVES AND USE THEREOF AS HISTAMINE 3 RECEPTOR MODULATORS | F. Hoffmann-Roche AG (CH) | 2010-05-12 | — | — | EP | disclosed |
| WO-2009013195-A1 | BENZOFURAN- AND BENZO[B]THIOPHENE-2-CARBOXYLIC ACID AMIDE DERIVATIVES AND USE THEREOF AS HISTAMINE 3 RECEPTOR MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2009-01-29 | — | — | WO | disclosed |