Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKAA2 | P54646 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | HMGCR | P04035 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8876589 | 0.85 | PRKAA2 (0.46) | PRKAA2RXRANR1I2NR4A2PDE4D | |
| SCHEMBL8878297 | 0.83 | RXRA (0.48) | PRKAA2RXRANR1I2NR4A2PDE4D | |
| SCHEMBL8878292 | 0.83 | RXRA (0.48) | PRKAA2RXRANR1I2NR4A2PDE4D | |
| SCHEMBL8878051 | 0.80 | PRKAA2 (0.66) | PRKAA2RXRADHODH | |
| SCHEMBL8879800 | 0.80 | GCGR (0.50) | HMGCRDHODH | |
| SCHEMBL8878327 | 0.78 | DHODH (0.51) | PRKAA2RXRADHODH | |
| SCHEMBL8877504 | 0.76 | PRKAA2 (0.46) | PRKAA2RXRADHODHKDM4E | |
| SCHEMBL8878315 | 0.76 | PRKAA2 (0.43) | PRKAA2RXRAHMGCRKDM4E | |
| SCHEMBL8952812 | 0.72 | NR1I2 (0.53) | RXRANR1I2NR4A2PDE4DHMGCR | |
| SCHEMBL8952803 | 0.72 | NR1I2 (0.53) | RXRANR1I2NR4A2PDE4DHMGCR |
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-5691322-A | Quinoline and pyridine anchors for HMG-CoA reductase inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1997-11-25 | — | — | US | disclosed |
| US-5686433-A | CHOLESTEROL BIOSYNTHESIS INHIBITION | E.R. SQUIBB & SONS, INC. (US) | 1997-11-11 | — | — | US | disclosed |
| US-5506219-A | ANTICHOLESTEROL AND ANTILIPEMIC AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1996-04-09 | — | — | US | disclosed |
| EP-0444533-A2 | Quinoline and pyridine anchors for HMG-CoA reductase inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1991-09-04 | — | — | EP | disclosed |