Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 3/20 | 0.38 |
| ▸ | MMP9 | P14780 | 3/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 2/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL4184927 | 1.00 | PPARG (0.39) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL4181876 | 1.00 | PPARG (0.39) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL4183418 | 1.00 | PPARG (0.39) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL10440676 | 1.00 | PPARG (0.39) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL8780385 | 0.90 | PPARG (0.39) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL9852424 | 0.90 | NPC1 (0.39) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL11107744 | 0.87 | PPARG (0.36) | PPARGCES2CES1MMP2MMP9 | |
| SCHEMBL10429679 | 0.83 | MMP2 (0.41) | MMP2MMP9 | |
| SCHEMBL2157188 | 0.82 | CYP3A4 (0.36) | — | |
| SCHEMBL9852458 | 0.81 | OPRM1 (0.39) | PPARGCES2CES1MMP2MMP9 |
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-5082587-A | ACHIRAL FLUORINE-CONTAINING LIQUID CRYSTALS | 3M INNOVATIVE PROPERTIES COMPANY | 1992-01-21 | — | — | US | disclosed |
| EP-0422996-A2 | Liquid crystal compound | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1991-04-17 | — | — | EP | disclosed |