Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 5/20 | 0.54 |
| ▸ | DHODH | Q02127 | 2/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | GCGR | P47871 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9849239 | 0.88 | HMGCR (0.48) | HMGCRDHODHAPPADORA2AADORA1 | |
| SCHEMBL8949911 | 0.81 | HMGCR (0.53) | HMGCRAPPADORA2AADORA1GCGR | |
| SCHEMBL8878207 | 0.81 | HMGCR (0.55) | HMGCRADORA2AADORA1GCGR | |
| SCHEMBL8879993 | 0.81 | HMGCR (0.49) | HMGCRDHODHADORA2AADORA1GCGR | |
| SCHEMBL8877873 | 0.81 | HMGCR (0.62) | HMGCRAPPADORA2AADORA1GCGR | |
| SCHEMBL27295913 | 0.78 | DHODH (0.46) | HMGCRDHODHAPPGCGRPTGDR | |
| SCHEMBL8876825 | 0.78 | PPARA (0.46) | HMGCRDHODHGCGRMAPT | |
| SCHEMBL8880943 | 0.78 | GCGR (0.45) | DHODHGCGR | |
| SCHEMBL8876720 | 0.78 | HMGCR (0.59) | HMGCRAPPADORA2AADORA1GCGR | |
| SCHEMBL8878856 | 0.77 | GCGR (0.46) | HMGCRGCGR |
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 3 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 |