Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | IL1B | P01584 | 4/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23545109 | 1.00 | HRH3 (0.33) | HRH3IL1BCHRM2CHRM4KDM1A | |
| SCHEMBL23545062 | 1.00 | HRH3 (0.33) | HRH3IL1BCHRM2CHRM4KDM1A | |
| SCHEMBL20936943 | 1.00 | HRH3 (0.33) | HRH3IL1BCHRM2CHRM4KDM1A | |
| SCHEMBL20936982 | 0.81 | ALDH1A1 (0.42) | HRH3IL1BJAK2JAK1 | |
| SCHEMBL23545106 | 0.81 | ALDH1A1 (0.42) | HRH3IL1BJAK2JAK1 | |
| SCHEMBL29919345 | 0.81 | ALDH1A1 (0.42) | HRH3IL1BJAK2JAK1 | |
| Hydrochloric Acid SCHEMBL23523614 | 0.79 | ALDH1A1 (0.41) | HRH3IL1BJAK2JAK1 | |
| Hydrochloric Acid SCHEMBL31119102 | 0.79 | ALDH1A1 (0.41) | HRH3IL1BJAK2JAK1 | |
| Hydrochloric Acid SCHEMBL23523613 | 0.79 | ALDH1A1 (0.41) | HRH3IL1BJAK2JAK1 | |
| Hydrochloric Acid SCHEMBL23523611 | 0.79 | ALDH1A1 (0.41) | HRH3IL1BJAK2JAK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019079783-A1 | ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 | VANDERBILT UNIVERSITY (US) | 2019-04-25 | — | — | WO | disclosed |