Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 5/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | HMGCR | P04035 | 3/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27688205 | 0.86 | GCGR (0.33) | GCGRCA12CA1CA2CA9 | |
| SCHEMBL2153893 | 0.81 | CA12 (0.38) | CA12CA1CA2CA9 | |
| SCHEMBL2011911 | 0.76 | ACHE (0.36) | GCGRPTGS2PTGS1MAPK14 | |
| SCHEMBL150097 | 0.75 | PTGS2 (0.35) | GCGRPTGS2PTGS1MAPK14 | |
| SCHEMBL13006374 | 0.73 | CA12 (0.56) | CA12CA1CA2CA9PTGS2 | |
| SCHEMBL2267523 | 0.72 | FAAH (0.30) | CA1CA2PTGS1 | |
| SCHEMBL9646652 | 0.72 | PTGS2 (0.34) | GCGRPTGS2PTGS1MAPK14 | |
| SCHEMBL6669375 | 0.72 | PIK3CA (0.35) | CA9PTGS2PTGS1 | |
| SCHEMBL2012244 | 0.72 | PTGS2 (0.39) | GCGRPTGS2PTGS1MAPK14 | |
| SCHEMBL3017108 | 0.71 | AKR1C3 (0.39) | — |
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-0948496-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE | Amgen inc. (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998024780-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE | AMGEN INC. (US) | 1998-06-11 | — | — | WO | disclosed |