Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SCN4A | P35499 | 8/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7418286 | 0.88 | TAAR1 (0.60) | HTR2ATAAR1CHRNB2CHRNA4SLC6A2 | |
| SCHEMBL6997156 | 0.83 | TAAR1 (0.44) | HTR2ATAAR1SLC6A4SCN4ALMNA | |
| SCHEMBL516439 | 0.81 | TAAR1 (0.59) | HTR2ATAAR1CHRNB2CHRNA4CYP2C19 | |
| SCHEMBL5171048 | 0.79 | HTR2A (0.73) | HTR2ATAAR1CHRNB2CHRNA4LMNA | |
| SCHEMBL9958098 | 0.79 | HTR2A (0.73) | HTR2ATAAR1CHRNB2CHRNA4LMNA | |
| SCHEMBL248883 | 0.79 | HTR2A (0.73) | HTR2ATAAR1CHRNB2CHRNA4LMNA | |
| SCHEMBL7416309 | 0.77 | SCN4A (0.39) | HTR2ATAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7418066 | 0.76 | TAAR1 (0.46) | HTR2ATAAR1CHRNB2CHRNA4SLC6A2 | |
| SCHEMBL7416098 | 0.74 | AOC3 (0.38) | TAAR1SLC6A2SLC6A4SLC6A3CYP2C19 | |
| SCHEMBL11436330 | 0.69 | TAAR1 (0.63) | HTR2ATAAR1CHRNB2CHRNA4SLC6A2 |
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 |