Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 16/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 13/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| SCHEMBL21313152 | 0.88 | ADORA2A (0.51) | ADORA2AADORA1ADORA2BADORA3HPGD | |
| SCHEMBL16223017 | 0.86 | ADORA2A (0.47) | ADORA2AADORA1HPGDNPSR1SMN1; SMN2 | |
| SCHEMBL12496524 | 0.84 | HPGD (0.47) | ADORA2AADORA1ADORA2BADORA3HPGD | |
| SCHEMBL12495836 | 0.84 | ADORA2A (0.55) | ADORA2AADORA1ADORA2BADORA3HPGD | |
| SCHEMBL16223135 | 0.83 | ADORA2A (0.58) | ADORA2AADORA1DHFR | |
| SCHEMBL12496000 | 0.81 | ADORA2A (0.46) | ADORA2AADORA1ADORA2BADORA3HPGD | |
| SCHEMBL12496017 | 0.81 | ADORA2A (0.58) | ADORA2AADORA1ADORA2BADORA3HPGD | |
| SCHEMBL21313215 | 0.81 | ADORA2A (0.47) | ADORA2AADORA1ADORA2BADORA3HPGD | |
| SCHEMBL12495903 | 0.81 | ADORA2A (0.44) | ADORA2AADORA1HPGDNPSR1DHFR | |
| SCHEMBL21313192 | 0.80 | ADORA2A (0.45) | ADORA2AADORA1NPSR1SMN1; SMN2NPC1 |
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 |