Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.55 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL637410 | 0.93 | CHRM2 (0.51) | CHRM2CHRM4CHRM5ALDH1A1LTA4H | |
| SCHEMBL636999 | 0.92 | CHRM2 (0.58) | CHRM2CHRM4CHRM5ALDH1A1HRH3 | |
| SCHEMBL20483452 | 0.86 | CHRM2 (0.64) | CHRM2CHRM4CHRM5ALDH1A1HRH3 | |
| SCHEMBL3082036 | 0.84 | CHRM2 (0.47) | CHRM2CHRM4CHRM5ALDH1A1HRH3 | |
| SCHEMBL3076478 | 0.84 | CHRM2 (0.47) | CHRM2CHRM4CHRM5ALDH1A1HRH3 | |
| SCHEMBL3083479 | 0.84 | CHRM2 (0.47) | CHRM2CHRM4CHRM5ALDH1A1HRH3 | |
| SCHEMBL3311708 | 0.84 | CHRM2 (0.54) | CHRM2CHRM4CHRM5ALDH1A1HRH3 | |
| SCHEMBL22533414 | 0.83 | LTA4H (0.43) | CHRM2CHRM4CHRM5ALDH1A1LTA4H | |
| SCHEMBL21548123 | 0.83 | CHRM2 (0.43) | CHRM2CHRM4CHRM5ALDH1A1LTA4H | |
| SCHEMBL14023655 | 0.83 | CHRM2 (0.43) | CHRM2CHRM4CHRM5ALDH1A1HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010120854-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-10-21 | — | — | WO | disclosed |
| WO-2010120854-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-10-21 | — | — | WO | disclosed |
| EP-0230274-A2 | Derivatives of 7-(azabicycloalkyl)-quinoloncarboxylic acid and -naphthyridoncarboxylic acid | BAYER AG (DE) | 1987-07-29 | — | — | EP | disclosed |