Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 6/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL8877873 | 0.88 | HMGCR (0.62) | HMGCRADORA2AADORA1GCGRMAPK14 | |
| SCHEMBL9849239 | 0.82 | HMGCR (0.48) | HMGCRADORA2AADORA1GCGRMAPK14 | |
| SCHEMBL9849206 | 0.77 | MEN1 (0.42) | HMGCRADORA2AMAPK14KDM4ELMNA | |
| SCHEMBL8876720 | 0.74 | HMGCR (0.59) | HMGCRADORA2AADORA1GCGR | |
| SCHEMBL8878207 | 0.73 | HMGCR (0.55) | HMGCRADORA2AADORA1GCGR | |
| SCHEMBL8949911 | 0.73 | HMGCR (0.53) | HMGCRADORA2AADORA1GCGRMAPK14 | |
| SCHEMBL8879043 | 0.72 | HMGCR (0.54) | HMGCRADORA2AADORA1GCGRKDM4E | |
| SCHEMBL9022533 | 0.69 | HMGCR (1.00) | HMGCR | |
| SCHEMBL9849071 | 0.69 | HMGCR (0.37) | HMGCRKDM4EL3MBTL1 | |
| SCHEMBL8878262 | 0.68 | HMGCR (0.52) | HMGCRADORA2AADORA1GCGRKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0444533-A2 | Quinoline and pyridine anchors for HMG-CoA reductase inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1991-09-04 | — | — | EP | disclosed |