Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.53 |
| ▸ | HRH1 | P35367 | 5/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | KLF10 | Q13118 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8384207 | 0.90 | HTR2A (0.60) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9857112 | 0.87 | HTR2A (0.53) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9856505 | 0.87 | HTR2A (0.53) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9856936 | 0.86 | SLC6A4 (0.55) | HTR2AHRH1SLC6A4SLC6A2CYP2D6 | |
| SCHEMBL9856731 | 0.86 | SLC6A4 (0.55) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9856456 | 0.84 | HTR2A (0.50) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9856612 | 0.83 | ALDH1A1 (0.61) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9856914 | 0.83 | HTR2A (0.49) | HTR2AHRH1SLC6A4SMN1; SMN2SLC6A2 | |
| SCHEMBL9856887 | 0.83 | HTR2A (0.49) | HTR2AHRH1SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL9856532 | 0.82 | SLC6A4 (0.58) | HTR2AHRH1SLC6A4SMN1; SMN2SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4996235-A | Selectively inhibiting the uptake of serotonin and norepinephrine | ELI LILLY AND COMPANY (US) | 1991-02-26 | — | — | US | disclosed |
| EP-0318233-A2 | Improvements in or relating to serotonin and norepinephrine uptake inhibitors | ELI LILLY AND COMPANY (US) | 1989-05-31 | — | — | EP | disclosed |