Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8926916 | 0.87 | PDE7A (0.41) | PTGS1PTGS2 | |
| SCHEMBL8926714 | 0.86 | PTGS1 (0.36) | PTGS1PTGS2 | |
| SCHEMBL8925113 | 0.85 | CA12 (0.45) | — | |
| SCHEMBL7800443 | 0.84 | SLC9A1 (0.56) | — | |
| SCHEMBL8925087 | 0.81 | PDE4B (0.41) | — | |
| SCHEMBL8926763 | 0.80 | SLC9A1 (0.37) | — | |
| SCHEMBL8926370 | 0.80 | SLC6A9 (0.36) | — | |
| SCHEMBL8926231 | 0.79 | RHEB (0.43) | — | |
| SCHEMBL8925017 | 0.78 | KDM4E (0.39) | PTGS1PTGS2 | |
| SCHEMBL8925003 | 0.78 | PTGS2 (0.41) | PTGS1PTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1058001-C | 4-Mercaptobenzoylguanidine derivatives | MERCK PATENT GMBH (DE) | 2000-11-01 | — | — | CN | disclosed |
| US-5696167-A | 4-mercaptobenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-12-09 | — | — | US | disclosed |
| CN-1134413-A | 4-Mercaptobenzoylguanidine derivatives | MERCK PATENT GMBH (DE) | 1996-10-30 | — | — | CN | disclosed |