Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6561512 | 0.81 | MT-CO2 (0.35) | KMT2A | |
| SCHEMBL6560067 | 0.69 | MT-CO2 (0.40) | PTGS1PTGS2 | |
| SCHEMBL11889215 | 0.62 | NCEH1 (0.52) | KMT2A | |
| SCHEMBL10732086 | 0.62 | JAK2 (0.40) | KMT2A | |
| SCHEMBL13403891 | 0.62 | CXCL8 (0.46) | PTGS1PTGS2KMT2A | |
| SCHEMBL5706168 | 0.62 | CXCL8 (0.46) | PTGS1PTGS2KMT2A | |
| SCHEMBL31612955 | 0.62 | CXCL8 (0.46) | PTGS1PTGS2KMT2A | |
| SCHEMBL3418020 | 0.61 | MT-CO2 (0.41) | PTGS1PTGS2KMT2A | |
| SCHEMBL7042944 | 0.61 | ACLY (0.35) | KMT2A | |
| SCHEMBL4735455 | 0.61 | GABRA1 (0.39) | PTGS1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0904079-B1 | ANTIDIABETIC AGENTS | MERCK & CO INC (US) | 2004-03-24 | — | — | EP | disclosed |
| EP-0904079-A4 | — | — | 1999-05-06 | — | — | EP | disclosed |
| EP-0904079-A1 | ANTIDIABETIC AGENTS | Merck & Co., Inc. (US) | 1999-03-31 | — | — | EP | disclosed |
| US-5859051-A | ACETYLPHENOL DERIVATIVES | MERCK & CO., INC. (US) | 1999-01-12 | — | — | US | disclosed |
| WO-1997027857-A1 | ANTIDIABETIC AGENTS | MERCK & CO., INC. (US) | 1997-08-07 | — | — | WO | disclosed |