Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | RARB | P10826 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 7/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29663153 | 1.00 | TSHR (0.48) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL10397802 | 0.92 | THRA (0.48) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL10523932 | 0.90 | THRA (0.48) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL8608185 | 0.89 | THRA (0.50) | TSHRNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9340758 | 0.88 | MAPT (0.39) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL9340763 | 0.88 | MAPT (0.39) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL7132551 | 0.88 | TSHR (0.39) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL7132762 | 0.88 | TSHR (0.39) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL7126417 | 0.88 | TSHR (0.39) | TSHRRARBNPC1LMNANFKB1 | |
| SCHEMBL9557208 | 0.88 | RARB (0.46) | TSHRRARBNPC1LMNANFKB1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5039246-A | — | — | None | — | — | JP | disclosed |
| EP-0497297-B1 | Liquid crystal compound and liquid crystal display device | MITSUBISHI GAS CHEMICAL CO (JP) | 1998-04-08 | — | — | EP | disclosed |
| US-5364560-A | Liquid crystal compound and liquid crystal display device | MITSUBISHI GAS CHEMICAL CO., INC. (JP) | 1994-11-15 | — | — | US | disclosed |
| JP-H0539246-A | FLUORINE-SUBSTITUTED LIQUID CRYSTAL SUBSTANCE | MITSUBISHI GAS CHEM CO INC | 1993-02-19 | — | — | JP | disclosed |
| EP-0497297-A2 | Liquid crystal compound and liquid crystal display device | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1992-08-05 | — | — | EP | disclosed |