Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 16/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 14/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5310520 | 0.98 | SLC6A3 (0.56) | SLC6A3SLC6A4SLC6A2TP53CYP3A4 | |
| Hydrochloric Acid SCHEMBL5308752 | 0.97 | SLC6A3 (0.57) | SLC6A3SLC6A4SLC6A2TP53CYP3A4 | |
| SCHEMBL11108390 | 0.86 | SLC6A3 (0.65) | SLC6A3SLC6A4SLC6A2TP53CYP3A4 | |
| SCHEMBL5309463 | 0.83 | SLC6A3 (0.46) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL2422 | 0.81 | SLC6A4 (0.54) | SLC6A3SLC6A4SLC6A2TP53CYP3A4 | |
| SCHEMBL5090597 | 0.81 | SLC6A3 (0.73) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL5310266 | 0.80 | SLC6A4 (0.60) | SLC6A3SLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL5306058 | 0.80 | SLC6A3 (0.67) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL5141057 | 0.78 | SLC6A3 (0.68) | SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL5141860 | 0.78 | SLC6A3 (0.68) | SLC6A3SLC6A4SLC6A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007041677-A9 | SOFT TISSUE IMPLANTS AND DRUG COMBINATION COMPOSITIONS, AND USE THEREOF | COMBINATORX INC (US) | 2007-05-31 | — | — | WO | disclosed |
| WO-2007041677-A2 | SOFT TISSUE IMPLANTS AND DRUG COMBINATION COMPOSITIONS, AND USE THEREOF | COMBINATORX, INCORPORATED (US) | 2007-04-12 | — | — | WO | disclosed |
| EP-1497272-A4 | METHOD OF PREPARING AMINE STEREOISOMERS | APSINTERM LLC (US) | 2007-02-07 | — | — | EP | disclosed |
| EP-1497272-A2 | METHOD OF PREPARING AMINE STEREOISOMERS | Apsinterm, LLC. (US) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003091207-A2 | METHOD OF PREPARING AMINE STEREOISOMERS | APSINTERM, LLC. (US) | 2003-11-06 | — | — | WO | disclosed |