Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL17568795 | 0.86 | SMN1; SMN2 (0.32) | SMN1; SMN2ALDH1A1GAAL3MBTL1 | |
| SCHEMBL17568791 | 0.82 | ABCB11 (0.37) | SMN1; SMN2GFERABCB11CHRM2CHRM4 | |
| SCHEMBL7526022 | 0.81 | CYP2C19 (0.39) | SMN1; SMN2LMNA | |
| SCHEMBL7521580 | 0.81 | ALDH1A1 (0.40) | SMN1; SMN2GFERALDH1A1L3MBTL1LMNA | |
| SCHEMBL7520457 | 0.81 | GRM5 (0.39) | SMN1; SMN2GFERALDH1A1LMNAADAMTS5 | |
| SCHEMBL7527996 | 0.80 | CPB1 (0.40) | SMN1; SMN2GFERALDH1A1ADAMTS5 | |
| SCHEMBL12593309 | 0.80 | CPB1 (0.40) | SMN1; SMN2GFERALDH1A1ADAMTS5 | |
| SCHEMBL7526060 | 0.80 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL7521707 | 0.80 | TACR3 (0.43) | SMN1; SMN2ALDH1A1GAAL3MBTL1LMNA | |
| SCHEMBL7518635 | 0.79 | HPGD (0.48) | SMN1; SMN2ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2153832-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-03-09 | — | — | EP | disclosed |