Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 3/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.30 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.30 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.30 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24608239 | 1.00 | HCAR3 (0.36) | HCAR3HRH3KDM1AJAK2JAK1 | |
| SCHEMBL25631508 | 0.81 | KDM1A (0.45) | HCAR3KDM1AJAK2JAK1CYP11B1 | |
| SCHEMBL20936923 | 0.79 | JAK2 (0.35) | HRH3KDM1AJAK2JAK1 | |
| SCHEMBL27680946 | 0.78 | HCAR3 (0.56) | HCAR3TDO2CYP11B1CYP11B2 | |
| SCHEMBL2709790 | 0.78 | HCAR3 (0.56) | HCAR3TDO2CYP11B1CYP11B2 | |
| SCHEMBL20936943 | 0.76 | HRH3 (0.33) | HRH3KDM1AJAK2JAK1 | |
| SCHEMBL20936804 | 0.76 | HRH3 (0.33) | HRH3KDM1AJAK2JAK1 | |
| SCHEMBL23545109 | 0.76 | HRH3 (0.33) | HRH3KDM1AJAK2JAK1 | |
| SCHEMBL23545062 | 0.76 | HRH3 (0.33) | HRH3KDM1AJAK2JAK1 | |
| SCHEMBL25631498 | 0.74 | DDB1 (0.43) | HRH3KDM1AJAK2JAK1FLT3 |
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 |