Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28635966 | 0.79 | CHRM2 (0.55) | CHRM2CHRM4CHRM5KCNH2OPRK1 | |
| SCHEMBL27969697 | 0.77 | MAPT (0.51) | CHRM2CHRM4CHRM5MEN1KMT2A | |
| SCHEMBL9356296 | 0.74 | CHRM2 (0.50) | CHRM2CHRM4CHRM5S1PR1S1PR5 | |
| SCHEMBL9352549 | 0.74 | CHRM2 (0.50) | CHRM2CHRM4CHRM5S1PR1S1PR5 | |
| SCHEMBL11097065 | 0.73 | SLC6A4 (0.48) | CHRM2CHRM4CHRM5KCNH2OPRK1 | |
| SCHEMBL11095157 | 0.73 | SLC6A4 (0.48) | CHRM2CHRM4CHRM5KCNH2OPRK1 | |
| Hydrochloric Acid SCHEMBL11093298 | 0.72 | CHRM2 (0.49) | CHRM2CHRM4CHRM5KCNH2OPRK1 | |
| SCHEMBL26695363 | 0.71 | FUCA1 (0.50) | CHRM2CHRM4CHRM5MEN1KMT2A | |
| SCHEMBL7362525 | 0.71 | S1PR5 (0.47) | CHRM2CHRM4CHRM5S1PR1S1PR5 | |
| SCHEMBL7359258 | 0.71 | S1PR5 (0.47) | CHRM2CHRM4CHRM5S1PR1S1PR5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109053532-A | The synthetic method of R-3- amino -2,5 dioxypyrrole -3- carboxylic acid, ethyl ester | 武汉理工大学 | 2018-12-21 | — | — | CN | claimed |