Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SLC6A6 | P31641 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1261334 | 0.97 | — | — | |
| SCHEMBL15297848 | 0.93 | TSHR (0.37) | TSHRPTGS1PDE4ALMNASLC6A6 | |
| SCHEMBL4662528 | 0.86 | TSHR (0.45) | TSHRPTGS1PDE4ALMNASLC6A6 | |
| SCHEMBL751071 | 0.84 | LMNA (0.43) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL9883940 | 0.83 | TSHR (0.46) | TSHRPTGS1PDE4ALMNASLC6A6 | |
| SCHEMBL15345876 | 0.81 | TSHR (0.45) | TSHRPTGS1PDE4ALMNASLC6A6 | |
| SCHEMBL13863427 | 0.81 | LMNA (0.45) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL10060664 | 0.80 | TDP1 (0.37) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL15282771 | 0.78 | LMNA (0.43) | PTGS1PDE4ALMNASLC6A6CYP2C19 | |
| SCHEMBL6049114 | 0.78 | LMNA (0.43) | PTGS1PDE4ALMNASLC6A6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0934261-A1 | PROCESS FOR PRODUCING MERCAPTOALKANESULFONATES AND PHOSPHONATES AND DERIVATIVES THEREOF | BIONUMERIK PHARMACEUTICALS, INC. (US) | 1999-08-11 | — | — | EP | disclosed |
| WO-1998014426-A1 | PROCESS FOR PRODUCING MERCAPTOALKANESULFONATES AND PHOSPHONATES AND DERIVATIVES THEREOF | BIONUMERIK PHARMACEUTICALS, INC. (US) | 1998-04-09 | — | — | WO | disclosed |