Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.44 |
| ▸ | HTR1A | P08908 | 6/20 | 0.44 |
| ▸ | HTR3A | P46098 | 6/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HRH2 | P25021 | 2/20 | 0.43 |
| ▸ | HTR1B | P28222 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL14723181 | 0.82 | SLC6A4 (0.57) | TDP1MAPTSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL29773377 | 0.82 | SLC6A4 (0.57) | TDP1MAPTSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL30338359 | 0.82 | SLC6A4 (0.57) | TDP1MAPTSLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL16151212 | 0.81 | SLC6A4 (0.55) | TDP1SLC6A4SLC6A3SLC6A2HTR1A | |
| Hydrochloric Acid SCHEMBL30695614 | 0.81 | SLC6A4 (0.55) | TDP1SLC6A4SLC6A3SLC6A2HTR1A | |
| SCHEMBL17553862 | 0.78 | HTR1A (0.48) | TDP1MAPTSLC6A4SLC6A3SLC6A2 | |
| SCHEMBL13057071 | 0.75 | HTR1A (0.57) | TDP1GAAMAPTSLC6A4SLC6A3 | |
| SCHEMBL14723137 | 0.75 | L3MBTL1 (0.52) | TDP1MAPTSLC6A4HTR1AHTR3A | |
| SCHEMBL17777979 | 0.73 | KMT2A (0.57) | TDP1MAPTSLC6A4HTR1AHTR3A | |
| SCHEMBL17777986 | 0.73 | HTR1A (0.44) | TDP1MAPTSLC6A4SLC6A3SLC6A2 |
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-2016079751-A2 | A PROCESS FOR PREPARATION OF VORTIOXETINE AND POLYMORPHS THEREOF | MEGAFINE PHARMA (P) LTD. (IN) | 2016-05-26 | — | — | WO | disclosed |