Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.37 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | DCTPP1 | Q9H773 | 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 | |
|---|---|---|---|---|
| SCHEMBL9730089 | 0.85 | ALDH1A1 (0.43) | PTGS2IDO1TDO2SLC5A1SLC5A2 | |
| SCHEMBL9730309 | 0.80 | PTGS2 (0.45) | PTGS2IDO1TDO2GABRA5GABRG2 | |
| Hydrochloric Acid SCHEMBL9730988 | 0.77 | IDO1 (0.38) | PTGS2IDO1TDO2SLC5A1SLC5A2 | |
| SCHEMBL9730226 | 0.74 | PTGS2 (0.43) | PTGS2IDO1TDO2SLC5A1SLC5A2 | |
| SCHEMBL498069 | 0.73 | NR1H4 (0.45) | GABRB3 | |
| SCHEMBL9730322 | 0.71 | HMGCR (0.50) | — | |
| SCHEMBL17699229 | 0.71 | ALDH1A1 (0.44) | PTGS2IDO1TDO2SLC5A1SLC5A2 | |
| SCHEMBL21834124 | 0.70 | GABRA5 (0.46) | PTGS2IDO1TDO2GABRA5GABRG2 | |
| SCHEMBL2683661 | 0.67 | PTGS2 (0.49) | PTGS2SLC5A1SLC5A2GABRA5GABRG2 | |
| Hydrochloric Acid SCHEMBL10533684 | 0.66 | KDM4E (0.40) | LMNAALDH1A1L3MBTL1MAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5081136-A | 1,2,3-TRIAZOLE COMPOUNDS ACTIVE AS INHIBITORS OF THE ENZYME HMG-COA REDUCTASE AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ZAMBON GROUP S.P.A. (IT) | 1992-01-14 | — | — | US | disclosed |
| EP-0433842-A2 | 1,2,3-Triazole derivatives active as inhibitors of the enzyme HMG-COA reductase and pharmaceutical compositions containing them | ZAMBON GROUP S.p.A. (IT) | 1991-06-26 | — | — | EP | disclosed |