Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7127715 | 0.85 | ALPL (0.34) | ALPLALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6422071 | 0.84 | ALPL (0.35) | ALPLPTGDR2PTGDRALDH1A1SLC6A3 | |
| SCHEMBL7122832 | 0.83 | ALPL (0.40) | ALPLALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6484099 | 0.79 | CYP1A2 (0.48) | ALPLALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6376468 | 0.78 | GCGR (0.38) | ALPLALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6421909 | 0.72 | MAPT (0.33) | ALPLMAPTBUB1 | |
| SCHEMBL6422907 | 0.71 | ALPL (0.39) | ALPLALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7128683 | 0.71 | CETP (0.43) | PTGDR2PTGDR | |
| SCHEMBL6421617 | 0.69 | CETP (0.42) | PTGDR2PTGDRSLC6A3SLC6A4 | |
| SCHEMBL8129664 | 0.68 | MAPT (0.45) | ALPLALDH1A1CYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6586613-B1 | Compounds such as 5-(tert-butyldimethylsiloxy)-7,7-dimethyl -4(4-fluorophenyl)-3-(hydroxy-(4-trifluorophenyl)-methyl)-2-isopropyl -5,6,7,8-tetrahydronaphthalene, used as antagonists for cholesteryl ester transferase protein; hyperlipemia | BAYER AKTIENGELLSCHAFT (DE) | 2003-07-01 | — | — | US | disclosed |