Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.60 |
| ▸ | HTR2A | P28223 | 4/20 | 0.60 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 2/20 | 0.45 |
| ▸ | SCN4A | P35499 | 5/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7414044 | 0.88 | HTR2A (0.45) | TAAR1HTR2ACHRNB2CHRNA4SCN4A | |
| SCHEMBL6997156 | 0.87 | TAAR1 (0.44) | TAAR1HTR2ASCN4ASLC6A4 | |
| SCHEMBL7418066 | 0.87 | TAAR1 (0.46) | TAAR1HTR2ACHRNB2CHRNA4HRH1 | |
| SCHEMBL7416309 | 0.80 | SCN4A (0.39) | TAAR1HTR2ASCN4ASLC6A2SLC6A4 | |
| SCHEMBL2066360 | 0.79 | TAAR1 (0.60) | TAAR1HTR2ACHRNB2CHRNA4HRH1 | |
| SCHEMBL7416098 | 0.77 | AOC3 (0.38) | TAAR1SCN4ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL149259 | 0.77 | HTR2A (1.00) | TAAR1HTR2ACHRNB2CHRNA4HRH1 | |
| Water SCHEMBL28365853 | 0.74 | HTR2A (0.94) | TAAR1HTR2ACHRNB2CHRNA4HRH1 | |
| Bromide SCHEMBL6737914 | 0.74 | HTR2A (0.94) | TAAR1HTR2ACHRNB2CHRNA4HRH1 | |
| Hydrochloric Acid SCHEMBL8550503 | 0.74 | HTR2A (0.94) | TAAR1HTR2ACHRNB2CHRNA4HRH1 |
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-1988003147-A1 | SELECTED N6-SUBSTITUTED ADENOSINES HAVING SELECTIVE A2 BINDING ACTIVITY | WARNER-LAMBERT COMPANY (US) | 1988-05-05 | — | — | WO | disclosed |