Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | HRH1 | P35367 | 3/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.41 |
| ▸ | DRD1 | P21728 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6580186 | 0.76 | AOC3 (0.36) | SLC6A4SLC6A2MAPK1HSD17B10MEN1 | |
| SCHEMBL4100718 | 0.76 | MAPK1 (0.41) | MAPK1HSD17B10MEN1KMT2A | |
| SCHEMBL2337792 | 0.71 | EPHX2 (0.38) | SLC6A4SLC6A2HRH1DRD1SLC6A3 | |
| SCHEMBL16959297 | 0.66 | GABRA1 (0.42) | SLC6A4SLC6A2CHRM1SLC6A3LMNA | |
| SCHEMBL6906704 | 0.66 | SLC6A4 (0.35) | SLC6A4SLC6A2SLC6A3KCNH2MAPK1 | |
| SCHEMBL6829520 | 0.65 | AOC3 (0.58) | SLC6A4SLC6A2HRH1SLC6A3HTR2A | |
| SCHEMBL31393937 | 0.65 | PTGDR2 (0.40) | SLC6A4SLC6A2SLC6A3LMNAMEN1 | |
| SCHEMBL31572076 | 0.65 | AOC3 (0.58) | SLC6A4SLC6A2HRH1SLC6A3HTR2A | |
| SCHEMBL6673940 | 0.65 | PTGDR2 (0.40) | SLC6A4SLC6A2SLC6A3LMNAMEN1 | |
| Hydrochloric Acid SCHEMBL5931958 | 0.65 | SLC6A4 (0.34) | SLC6A4SLC6A2SLC6A3MAPK1HSD17B10 |
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-2008059514-A2 | PROCESS FOR PREPARING ESCITALOPRAM | CADILA HEALTHCARE LIMITED (IN) | 2008-05-22 | — | — | WO | disclosed |