Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 14/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.68 |
| ▸ | HRH1 | P35367 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | ATP4A | P20648 | 4/20 | 0.61 |
| ▸ | ATP4B | P51164 | 4/20 | 0.61 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.60 |
| ▸ | LTA4H | P09960 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL4094594 | 0.82 | HRH3 (1.00) | HRH3KCNH2HRH1HRH4LTA4H | |
| SCHEMBL12050718 | 0.82 | HRH3 (0.96) | HRH3KCNH2HRH1HRH4LTA4H | |
| SCHEMBL2885124 | 0.82 | HRH3 (0.53) | HRH3KCNH2HRH1ATP4AATP4B | |
| SCHEMBL12017606 | 0.81 | HRH3 (0.72) | HRH3KCNH2HRH1 | |
| SCHEMBL491626 | 0.81 | HRH3 (1.00) | HRH3KCNH2HRH1HRH4LTA4H | |
| SCHEMBL4094339 | 0.80 | HRH3 (1.00) | HRH3KCNH2HRH1HRH4 | |
| SCHEMBL12050645 | 0.80 | HRH3 (1.00) | HRH3KCNH2HRH1HRH4 | |
| SCHEMBL6847832 | 0.80 | CYP1A2 (0.58) | HRH3KCNH2HRH1CYP1A2CYP2D6 | |
| SCHEMBL5214535 | 0.79 | HRH3 (0.57) | HRH3KCNH2CYP1A2CYP2D6CYP19A1 | |
| SCHEMBL492205 | 0.78 | HRH3 (0.84) | HRH3KCNH2HRH1HRH4LTA4H |
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-1301480-A1 | 1,3-DISUBSTITUTED AND 1,3,3-TRISUBSTITUTED PYRROLIDINES AS HISTAMINE-3 RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS | ABBOTT LABORATORIES (US) | 2003-04-16 | — | — | EP | disclosed |
| WO-2002006223-A1 | 1,3-DISUBSTITUTED AND 1,3,3-TRISUBSTITUTED PYRROLIDINES AS HISTAMINE-3 RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS | ABBOTT LABORATORIES (US) | 2002-01-24 | — | — | WO | disclosed |