Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.67 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.52 |
| ▸ | HRH1 | P35367 | 2/20 | 0.46 |
| ▸ | KIF11 | P52732 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13934689 | 0.81 | TRPA1 (0.44) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7439094 | 0.80 | SLC6A3 (1.00) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL7438013 | 0.78 | SLC6A3 (0.96) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL21647216 | 0.78 | CYP1A2 (0.41) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL12128404 | 0.77 | KMT2A (0.44) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL31290434 | 0.76 | CYSLTR2 (0.50) | CYP2C19 | |
| SCHEMBL9771151 | 0.76 | SLC6A3 (0.81) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL31290368 | 0.76 | HTR2A (0.42) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11777659 | 0.76 | TSHR (0.40) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL18594722 | 0.76 | KMT2A (0.43) | SLC6A4SLC6A3CYP1A2CYP2D6CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5021431-A | H-1 antagonist, h-2 agonist for treating hypertension, cardiac disease or arterial occlusion | HEUMANN PHARMA GMBH & CO. (DE) | 1991-06-04 | — | — | US | disclosed |
| EP-0199845-B1 | IMIDAZOLYLALKYLGUANIDIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | HEUMANN PHARMA GMBH & CO (DE) | 1990-08-01 | — | — | EP | disclosed |
| EP-0199845-A1 | Imidazolylalkylguanidin derivatives, process for their preparation and pharmaceutical compositions containing them | HEUMANN PHARMA GMBH & CO (DE) | 1986-11-05 | — | — | EP | disclosed |