Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.64 |
| ▸ | SLC6A3 | Q01959 | 19/20 | 0.64 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL14347766 | 0.96 | SLC6A4 (0.69) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL16691391 | 0.94 | SLC6A4 (0.72) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL8353023 | 0.92 | SLC6A4 (0.58) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL16823453 | 0.83 | SLC6A4 (0.62) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9270769 | 0.83 | SLC6A4 (0.90) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL12745074 | 0.82 | SLC6A4 (0.89) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL14347859 | 0.81 | SLC6A4 (0.44) | SLC6A4SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL1461690 | 0.81 | SLC6A4 (0.86) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL9427449 | 0.80 | SLC6A4 (0.58) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL8354195 | 0.80 | MCHR1 (0.49) | SLC6A4SLC6A3SLC6A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7312214-B2 | 1, 1-disubstituted cycloalkyl derivatives as factor Xa inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-12-25 | — | — | US | disclosed |
| WO-2003099276-A1 | 1,1-DISUBSTITUTED CYCLOALKYL DERIVATIVES AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-12-04 | — | — | WO | disclosed |