Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16223017 | 0.93 | ADORA2A (0.47) | ADORA2AADORA1TLR8DRD2HTR6 | |
| SCHEMBL16223135 | 0.89 | ADORA2A (0.58) | ADORA2AADORA1TLR8DRD2HTR6 | |
| SCHEMBL21313140 | 0.89 | TLR8 (0.46) | ADORA2AADORA1TLR8GCGRALDH1A1 | |
| SCHEMBL16223083 | 0.87 | ADORA2A (0.43) | ADORA2AADORA1TLR8DRD2HTR6 | |
| SCHEMBL16223070 | 0.86 | CYP3A4 (0.50) | ADORA2AADORA1TLR8SMN1; SMN2NPSR1 | |
| SCHEMBL16223036 | 0.85 | HRH2 (0.52) | ADORA2AADORA1TLR8CDK5CDK5R1 | |
| SCHEMBL12495826 | 0.85 | ADK (0.44) | ADORA2AADORA1TLR8DRD2HTR6 | |
| SCHEMBL12495746 | 0.84 | ADORA2A (0.42) | ADORA2AADORA1TLR8DRD2HTR6 | |
| SCHEMBL21313194 | 0.83 | TLR8 (0.54) | ADORA2AADORA1TLR8TLR7 | |
| SCHEMBL21313155 | 0.83 | CHRNA7 (0.43) | ADORA2AADORA1TLR8DRD2HTR6 |
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 |