Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 6/20 | 0.53 |
| ▸ | GCGR | P47871 | 3/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PDE6D | O43924 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8877825 | 0.84 | GCGR (0.53) | HMGCRGCGR | |
| SCHEMBL8846369 | 0.84 | HMGCR (0.53) | HMGCRGCGRDPP4HTR2AHTR2C | |
| SCHEMBL9562922 | 0.84 | HMGCR (0.56) | HMGCRGCGRDPP4HTR2AHTR2C | |
| SCHEMBL9521683 | 0.84 | HMGCR (0.53) | HMGCRGCGRDPP4HTR2AHTR2C | |
| SCHEMBL10433920 | 0.82 | HMGCR (0.53) | HMGCRGCGRDPP4ALDH1A1CYP3A4 | |
| SCHEMBL8879114 | 0.82 | GCGR (0.51) | HMGCRGCGR | |
| SCHEMBL9562749 | 0.81 | HMGCR (0.56) | HMGCRGCGRDPP4HTR2AHTR2C | |
| SCHEMBL9562755 | 0.81 | HMGCR (0.56) | HMGCRGCGRDPP4HTR2AHTR2C | |
| SCHEMBL8879800 | 0.81 | GCGR (0.50) | HMGCRGCGR | |
| SCHEMBL8877472 | 0.81 | GCGR (0.50) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5202327-A | PHOSPHORUS-CONTAINING HMG-COA REDUCTASE INHIBITORS | E. R. SQUIBB & SONS, INC. (US) | 1993-04-13 | — | — | US | disclosed |
| EP-0522431-A1 | Phophorus-containing HMG-COA reductase inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1993-01-13 | — | — | EP | disclosed |