Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | ADK | P55263 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21313192 | 0.93 | ADORA2A (0.45) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL16223135 | 0.93 | ADORA2A (0.58) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL16223083 | 0.91 | ADORA2A (0.43) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL12495746 | 0.90 | ADORA2A (0.42) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL16223036 | 0.88 | HRH2 (0.52) | ADORA2AADORA1TLR8CDK5CDK5R1 | |
| SCHEMBL12495826 | 0.88 | ADK (0.44) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL12495903 | 0.88 | ADORA2A (0.44) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL16223070 | 0.87 | CYP3A4 (0.50) | ADORA2AADORA1TLR8TLR7CYP2A6 | |
| SCHEMBL21313155 | 0.86 | CHRNA7 (0.43) | ADORA2AADORA1DRD2HTR6TLR8 | |
| SCHEMBL16223064 | 0.86 | ADORA2A (0.45) | ADORA2AADORA1SMN1; SMN2HPGDNPSR1 |
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-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 |
| US-8883798-B2 | 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) | 2014-11-11 | — | — | US | claimed |