Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6280599 | 0.82 | PPARA (0.33) | PPARAKDM4E | |
| SCHEMBL6275650 | 0.81 | PPARA (0.37) | CYP3A4HSP90AA1PPARAHIF1AKDM4E | |
| SCHEMBL6511105 | 0.81 | CYP3A4 (0.47) | CYP3A4HSP90AA1PPARAHIF1AKDM4E | |
| SCHEMBL6275352 | 0.79 | HMGCR (0.39) | HSP90AA1PPARAHIF1A | |
| SCHEMBL6280858 | 0.77 | KDM4E (0.34) | PPARAKDM4E | |
| SCHEMBL6276984 | 0.75 | PPARA (0.39) | PPARAPPARG | |
| SCHEMBL6276980 | 0.75 | PPARA (0.39) | PPARAPPARG | |
| SCHEMBL6515500 | 0.75 | CYP3A4 (0.38) | CYP3A4HSP90AA1PPARAKDM4EPPARG | |
| SCHEMBL6281433 | 0.74 | PPARA (0.34) | PPARAKDM4E | |
| SCHEMBL6281431 | 0.74 | PPARA (0.34) | PPARAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005042509-A1 | 7-`(7-ALKOXY)-CHROM-3-EN-6-YL!-HEPTATRIENOIC ACID AND 7-`(3ALKOXY)-5,6-DIHYDRONAPHTHALEN-2-YL!-HEPTATRIENOIC ACID DERIVATIVES MODULATORS | ALLERGAN, INC. (US) | 2005-05-12 | — | — | WO | disclosed |