Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 3/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6969379 | 0.84 | ALOX5 (0.34) | ALOX5 | |
| SCHEMBL6976938 | 0.77 | HTT (0.37) | ALDH1A1KDM4EMAPT | |
| SCHEMBL5887952 | 0.75 | MAPK1 (0.42) | PPARGHSD17B10ALDH1A1KDM4EMAPT | |
| SCHEMBL7509630 | 0.71 | ALDH1A1 (0.36) | ALDH1A1KMT2AKDM4EMAPT | |
| SCHEMBL6978894 | 0.70 | HSD17B10 (0.37) | PPARGPPARAHSD17B10ALDH1A1MEN1 | |
| SCHEMBL5230123 | 0.70 | CHRNA7 (0.38) | HSD17B10ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL5888342 | 0.69 | DAO (0.40) | ALDH1A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL5234682 | 0.68 | CHRNA7 (0.41) | HSD17B10ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL5231463 | 0.67 | SLC9A1 (0.47) | HSD17B10ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL5887962 | 0.65 | CYP2A6 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214316-B1 | FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES | CLARIANT INT LTD (CH) | 2003-05-07 | — | — | EP | disclosed |
| EP-1214316-A1 | FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES | CLARIANT INTERNATIONAL LTD. (CH) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001016131-A2 | FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES | CLARIANT INTERNATIONAL LTD (CH) | 2001-03-08 | — | — | WO | disclosed |