Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.54 |
| ▸ | RAB9A | P51151 | 7/20 | 0.54 |
| ▸ | NPC1 | O15118 | 6/20 | 0.54 |
| ▸ | TP53 | P04637 | 3/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.40 |
| ▸ | RELA | Q04206 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8766676 | 0.93 | RAB9A (0.50) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766722 | 0.92 | RAB9A (0.49) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9434295 | 0.90 | NPC1 (0.41) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9433719 | 0.90 | SMN1; SMN2 (0.48) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766807 | 0.85 | RAB9A (0.39) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8767583 | 0.85 | NPC1 (0.39) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9433261 | 0.83 | RAB9A (0.47) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9433608 | 0.82 | RAB9A (0.46) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766245 | 0.82 | ALDH1A1 (0.41) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766258 | 0.82 | CYP17A1 (0.37) | SMN1; SMN2RAB9ANPC1TP53PKM |
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-0543244-B1 | Fluoro substituted tolans and liquid crystal mixtures containing them | MERCK PATENT GMBH (DE) | 1997-08-20 | — | — | EP | disclosed |
| US-5372746-A | Fluoro-substituted tolane compounds and liquid crystalline mixtures containing same | HOFFMANN-LA ROCHE INC. (US) | 1994-12-13 | — | — | US | disclosed |
| EP-0543244-A1 | Fluoro substituted tolans and liquid crystal mixtures containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1993-05-26 | — | — | EP | disclosed |