Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1502417 | 0.90 | NPSR1 (0.36) | NPSR1KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL1502449 | 0.81 | KDM4E (0.41) | NPSR1KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL12759795 | 0.77 | NPSR1 (0.38) | NPSR1 | |
| SCHEMBL19373435 | 0.72 | CYP4F2 (0.47) | NPSR1KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL24906929 | 0.72 | NPSR1 (0.36) | NPSR1 | |
| SCHEMBL1502301 | 0.67 | NPSR1 (0.37) | NPSR1 | |
| SCHEMBL12251757 | 0.67 | CYP4F2 (0.43) | NPSR1LMNA | |
| SCHEMBL12759874 | 0.67 | CHRM1 (0.37) | NPSR1KDM4EALDH1A1LMNA | |
| SCHEMBL2445606 | 0.67 | NPSR1 (0.46) | NPSR1ALDH1A1LMNATSHR | |
| SCHEMBL23639717 | 0.66 | CHRM1 (0.35) | NPSR1ALDH1A1LMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004058730-A2 | TRIAZOLE DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE-1 | MERCK & CO., INC. (US) | 2004-07-15 | — | — | WO | disclosed |