Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 7/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.48 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.48 |
| ▸ | DHFR | P00374 | 2/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21313145 | 0.95 | DHFR (0.49) | TLR8ADORA2ADHFRHRH3BCHE | |
| SCHEMBL21313261 | 0.91 | MAPK11 (0.44) | TLR8ADORA2ANUDT1DHFRHRH3 | |
| SCHEMBL21313221 | 0.90 | ADORA2A (0.51) | TLR8ADORA2ANUDT1DHFRHRH3 | |
| SCHEMBL21313263 | 0.88 | KDM4E (0.44) | TLR8ADORA2ADHFRHRH3ADORA1 | |
| SCHEMBL21313166 | 0.88 | ADORA2A (0.55) | TLR8ADORA2ADHFRHRH3ADORA1 | |
| SCHEMBL12495851 | 0.86 | TLR8 (0.60) | TLR8ADORA2ANUDT1DHFRADORA1 | |
| SCHEMBL12495576 | 0.86 | ADORA2A (0.53) | TLR8ADORA2ADHFRHRH3ADORA1 | |
| SCHEMBL16223072 | 0.86 | ADORA2A (0.42) | TLR8ADORA2ANUDT1DHFRHRH3 | |
| SCHEMBL21313163 | 0.84 | TGFBR1 (0.49) | TLR8ADORA2ADHFRHRH3 | |
| SCHEMBL21313203 | 0.83 | ADORA2A (0.48) | TLR8ADORA2ADHFRHRH3ADORA1 |
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 |