Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 10/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 6/20 | 0.44 |
| ▸ | MAPK12 | P53778 | 6/20 | 0.44 |
| ▸ | MAPK11 | Q15759 | 6/20 | 0.44 |
| ▸ | GCGR | P47871 | 5/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | FRK | P42685 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12495989 | 0.93 | ADORA2A (0.51) | ADORA2AGCGRADORA2BADORA1 | |
| SCHEMBL21313140 | 0.91 | TLR8 (0.46) | ADORA2AGCGRADORA1GSK3B | |
| SCHEMBL12496108 | 0.87 | ADORA2A (0.57) | ADORA2AGCGRADORA2BADORA1 | |
| SCHEMBL12496127 | 0.85 | KDM4E (0.48) | ADORA2AGCGRADORA1 | |
| SCHEMBL21313194 | 0.85 | TLR8 (0.54) | MAPK14ADORA2AMAPK13MAPK12MAPK11 | |
| SCHEMBL16223083 | 0.84 | ADORA2A (0.43) | ADORA2AGCGRADORA2BADORA1 | |
| SCHEMBL12496112 | 0.83 | HRH2 (0.56) | MAPK14ADORA2AMAPK13MAPK12MAPK11 | |
| SCHEMBL12495759 | 0.83 | HRH2 (0.56) | MAPK14ADORA2AMAPK13MAPK12MAPK11 | |
| SCHEMBL12495729 | 0.83 | ADORA2A (0.46) | ADORA2AGCGRADORA2BADORA1 | |
| SCHEMBL21313243 | 0.82 | ADORA2A (0.46) | MAPK14ADORA2AGCGRADORA2BADORA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3195867-B1 | PYRIMIDINE COMPOUNDS INHIBITING THE FORMATION OF NITRIC OXIDE AND PROSTAGLANDIN E2, METHOD OF PRODUCTION THEREOF AND USE THEREOF | USTAV ORGANICKE CHEMIE A BIOCHEMIE AKADEMIE VED CR V V I (CZ) | 2019-09-04 | — | — | EP | claimed |