Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 10/20 | 0.84 |
| ▸ | NOS1 | P29475 | 8/20 | 0.84 |
| ▸ | NOS3 | P29474 | 2/20 | 0.84 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 2/20 | 0.35 |
| ▸ | HRH1 | P35367 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
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 SCHEMBL8376625 | 0.99 | NOS2 (0.82) | NOS2NOS1NOS3OPRD1OPRK1 | |
| SCHEMBL7938128 | 0.97 | NOS2 (0.82) | NOS2NOS1NOS3OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL8518505 | 0.96 | NOS2 (0.81) | NOS2NOS1NOS3OPRD1OPRK1 | |
| SCHEMBL7941223 | 0.96 | NOS2 (0.81) | NOS2NOS1NOS3OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL8381058 | 0.95 | NOS2 (0.79) | NOS2NOS1NOS3OPRD1OPRK1 | |
| SCHEMBL7931849 | 0.94 | NOS2 (0.87) | NOS2NOS1NOS3OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL8379849 | 0.93 | NOS2 (0.85) | NOS2NOS1NOS3OPRD1OPRK1 | |
| SCHEMBL7941336 | 0.91 | NOS2 (0.79) | NOS2NOS1NOS3OPRD1OPRK1 | |
| SCHEMBL7940883 | 0.91 | NOS2 (1.00) | NOS2NOS1NOS3OPRD1KCNH2 | |
| Hydrochloric Acid SCHEMBL8377784 | 0.91 | NOS2 (0.77) | NOS2NOS1NOS3OPRD1OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |