Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | GAA | P10253 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 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 SCHEMBL8376464 | 0.99 | NOS2 (0.44) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL27506963 | 0.83 | NOS2 (0.55) | NOS2ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL7806671 | 0.68 | NOS2 (0.57) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7806770 | 0.67 | NOS2 (0.52) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8377837 | 0.67 | NOS2 (0.51) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7806698 | 0.67 | NOS2 (0.54) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL13278237 | 0.66 | LPO (0.49) | KDM4EALDH1A1GAASMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL8379182 | 0.66 | NOS2 (0.44) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7806768 | 0.66 | NOS2 (0.44) | NOS2KDM4EALDH1A1GAASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8379186 | 0.66 | NOS2 (0.53) | NOS2KDM4EALDH1A1GAASMN1; SMN2 |
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 |