Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 16/20 | 0.61 |
| ▸ | NOS3 | P29474 | 5/20 | 0.53 |
| ▸ | NOS1 | P29475 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8381046 | 0.99 | NOS2 (0.59) | NOS2NOS3NOS1HSD17B10KDM4E | |
| SCHEMBL7940842 | 0.80 | NOS2 (0.65) | NOS2NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL8380046 | 0.79 | NOS2 (0.64) | NOS2NOS3NOS1 | |
| SCHEMBL7806689 | 0.76 | NOS2 (1.00) | NOS2NOS3NOS1HSD17B10KDM4E | |
| Hydrochloric Acid SCHEMBL8379794 | 0.75 | NOS2 (0.97) | NOS2NOS3NOS1HSD17B10KDM4E | |
| SCHEMBL7802794 | 0.73 | NOS2 (1.00) | NOS2NOS3NOS1HSD17B10KDM4E | |
| SCHEMBL7802808 | 0.72 | NOS2 (0.78) | NOS2NOS3NOS1HSD17B10KDM4E | |
| SCHEMBL7931738 | 0.72 | NOS2 (0.58) | NOS2NOS1 | |
| SCHEMBL3336302 | 0.72 | NOS2 (0.33) | NOS2NOS3 | |
| Hydrochloric Acid SCHEMBL8378309 | 0.71 | NOS2 (0.96) | NOS2NOS3NOS1HSD17B10KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6248745-B1 | MIXTURE COMPRISING A CYCLOOXYGENASE-2 (COX-2) INHIBITOR AND A 1,2-DIHYDRO-4-AMINOQUINAZOLINE DERIVATIVE INHIBITOR OF INDUCED NITRIC OXIDE SYNTHASE (INOS); NON-STEROIDAL ANTIINFLAMMATORY AGENTS | ASTRAZENECA AB (SE) | 2001-06-19 | — | — | US | claimed |
| EP-1100505-A1 | A PHARMACEUTICAL COMBINATION COMPRISING A COX-2 INHIBITOR AND A iNOS INHIBITOR | AstraZeneca AB (SE) | 2001-05-23 | — | — | EP | claimed |
| WO-2000000200-A1 | A PHARMACEUTICAL COMBINATION COMPRISING A COX-2 INHIBITOR AND A iNOS INHIBITOR | ASTRAZENECA AB (SE) | 2000-01-06 | — | — | WO | claimed |
| CN-1204327-A | Pharmaceutically active quinazoline compounds | ASTRA PHARMA PROD (GB) | 1999-01-06 | — | — | CN | disclosed |