Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.52 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5593730 | 0.74 | SLC6A4 (0.40) | SLC6A4SLC6A3 | |
| SCHEMBL5511034 | 0.74 | TOP2A (0.48) | SLC6A4SLC6A3 | |
| SCHEMBL9528231 | 0.72 | HTR2A (1.00) | HTR2ATAAR1CHRNB2CHRNA4SLC6A4 | |
| SCHEMBL9531164 | 0.72 | HTR2A (1.00) | HTR2ATAAR1CHRNB2CHRNA4SLC6A4 | |
| SCHEMBL9533613 | 0.72 | HTR2A (1.00) | HTR2ATAAR1CHRNB2CHRNA4SLC6A4 | |
| SCHEMBL604916 | 0.72 | TAAR1 (0.58) | HTR2ATAAR1CHRNB2CHRNA4SLC6A4 | |
| SCHEMBL3902718 | 0.72 | HTR2A (0.68) | HTR2ATAAR1CHRNB2CHRNA4HRH1 | |
| SCHEMBL149259 | 0.71 | HTR2A (1.00) | HTR2ATAAR1CHRNB2CHRNA4SLC6A4 | |
| SCHEMBL31255182 | 0.70 | SLC6A4 (0.42) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL4134081 | 0.70 | EPHX1 (0.44) | TAAR1SLC6A4SLC6A3SLC6A2 |
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-2007070816-A2 | THIOPHENE DERIVATIVES AS FACTOR XIA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-06-21 | — | — | WO | disclosed |