Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | PREP | P48147 | 3/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1409867 | 0.98 | HRH3 (0.41) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL1409871 | 0.91 | BTK (0.47) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL3637877 | 0.84 | BTK (0.44) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL1295721 | 0.83 | HRH3 (0.51) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL28492122 | 0.83 | HRH3 (0.51) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL186721 | 0.83 | HRH3 (0.51) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL17754267 | 0.82 | HRH3 (0.43) | HRH3BTKPREPMAPK1GPR119 | |
| SCHEMBL1296976 | 0.82 | HRH3 (0.41) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL5329004 | 0.81 | CHRNB2 (0.41) | HRH3CHRM2CHRM1CHRM3BTK | |
| SCHEMBL4228795 | 0.80 | SMN1; SMN2 (0.42) | HRH3CHRM2CHRM1CHRM3BTK |
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-2491031-A1 | FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS | Janssen Pharmaceutica N.V. (BE) | 2012-08-29 | — | — | EP | disclosed |
| WO-2011050202-A1 | FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-04-28 | — | — | WO | disclosed |