Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | RORC | P51449 | 4/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28027118 | 1.00 | HTR2A (0.34) | HTR2AWDR5SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28027152 | 1.00 | HTR2A (0.34) | HTR2AWDR5SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2179695 | 0.83 | HTR2A (0.31) | HTR2A | |
| SCHEMBL28775360 | 0.82 | HTR2A (0.53) | HTR2ASLC6A2SLC6A4RORC | |
| SCHEMBL2180201 | 0.81 | HTR2A (0.38) | HTR2AWDR5SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL516639 | 0.79 | WDR5 (0.44) | WDR5 | |
| SCHEMBL29233469 | 0.79 | RORC (0.32) | HTR2ASLC6A2SLC6A4SLC6A3RORC | |
| SCHEMBL19262542 | 0.73 | RORC (0.38) | SLC6A4SLC6A3RORCNR1I2NR1H3 | |
| SCHEMBL118703 | 0.72 | TSHR (0.41) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14844322 | 0.72 | SLC6A4 (0.33) | HTR2ASLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105121444-A | Acyclic cyanoethylpyrazolo pyridones as JANUS kinase inhibitors | MERCK SHARP & DOHME | 2015-12-02 | — | — | CN | disclosed |