Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.46 |
| ▸ | HTR2B | P41595 | 8/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.45 |
| ▸ | FPR2 | P25090 | 2/20 | 0.44 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28078743 | 0.88 | SLC6A4 (0.46) | HTR2CHTR2BSLC6A4FPR2PROKR1 | |
| SCHEMBL5367403 | 0.86 | HTR2C (0.54) | HTR2CHTR2BSLC6A4FPR2PROKR1 | |
| Tert-Butyl Formate SCHEMBL28072762 | 0.85 | NMT1 (0.40) | HTR2CHTR2BSLC6A2SLC6A3 | |
| Tert-Butyl Formate SCHEMBL28291789 | 0.84 | GPR6 (0.40) | SLC6A2SLC6A3 | |
| Tert-Butyl Formate SCHEMBL28078907 | 0.79 | HRH1 (0.43) | HTR2CHTR2BSLC6A4 | |
| Tert-Butyl Formate SCHEMBL27805796 | 0.79 | UTS2R (0.43) | HTR2CHTR2BSLC6A4SLC6A2SLC6A3 | |
| Tert-Butyl Formate SCHEMBL28221270 | 0.77 | HTR1A (0.39) | HTR2CHTR2BSLC6A4HTR6DDR1 | |
| SCHEMBL13034355 | 0.77 | SLC6A4 (0.52) | HTR2CHTR2BSLC6A4HTR6DDR1 | |
| Tert-Butyl Formate SCHEMBL27771463 | 0.76 | IKBKB (0.41) | SLC6A4SLC6A2SLC6A3 | |
| Tert-Butyl Formate SCHEMBL28072558 | 0.76 | CHRM1 (0.40) | — |
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-106103421-A | The pyrazine regulator of GPR6 | 武田药品工业株式会社 | 2016-11-09 | — | — | CN | disclosed |