Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 13/20 | 0.46 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20846262 | 0.83 | HTR6 (0.45) | SLC6A4HTR6MAP3K14SLC6A2SLC6A3 | |
| SCHEMBL31490967 | 0.80 | SLC6A4 (0.49) | SLC6A4HTR6IDO1MAP3K14SLC6A2 | |
| SCHEMBL29940685 | 0.80 | SLC6A4 (0.49) | SLC6A4HTR6IDO1SLC6A2SLC6A3 | |
| SCHEMBL28796216 | 0.80 | SLC6A4 (0.49) | SLC6A4HTR6IDO1SLC6A2SLC6A3 | |
| SCHEMBL28694001 | 0.78 | IDO1 (0.51) | SLC6A4IDO1HTR1AHTR2A | |
| SCHEMBL28150092 | 0.76 | TUBB4A (0.49) | IDO1HTR1AHTR2A | |
| SCHEMBL28534770 | 0.76 | IDO1 (0.49) | SLC6A4HTR6IDO1HTR1AHTR2A | |
| SCHEMBL28534743 | 0.76 | IDO1 (0.54) | SLC6A4IDO1HTR2A | |
| SCHEMBL28693099 | 0.76 | SLC6A4 (0.43) | SLC6A4HTR6IDO1MAP3K14SLC6A2 | |
| SCHEMBL13323651 | 0.73 | HTR6 (0.63) | SLC6A4HTR6IDO1MAP3K14SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105985266-B | Trifluoromethylthio reagent, preparation method and applications | 中国科学院上海有机化学研究所 | 2018-02-16 | — | — | CN | disclosed |
| CN-105985266-A | Trifluoromethylthiolation reagent, and preparation method and application thereof | 中国科学院上海有机化学研究所 | 2016-10-05 | — | — | CN | disclosed |