Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 6/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 4/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8766819 | 0.96 | RARB (0.43) | RARBRAB9ASMN1; SMN2NPC1HSD17B10 | |
| SCHEMBL8767583 | 0.93 | NPC1 (0.39) | RARBRAB9ASMN1; SMN2NPC1HSD17B10 | |
| SCHEMBL9434621 | 0.90 | RARB (0.36) | RARBRAB9ASMN1; SMN2NPC1HSD17B10 | |
| SCHEMBL8767204 | 0.88 | RXRA (0.36) | GRM5PIK3CAMTOR | |
| SCHEMBL8766887 | 0.87 | MTOR (0.35) | HSD17B10GRM5CYP1A2CYP3A4TSHR | |
| SCHEMBL9434234 | 0.86 | RARB (0.40) | RARBRAB9ASMN1; SMN2NPC1HSD17B10 | |
| SCHEMBL8766676 | 0.86 | RAB9A (0.50) | RAB9ASMN1; SMN2NPC1HSD17B10KDM4E | |
| SCHEMBL8766722 | 0.83 | RAB9A (0.49) | RAB9ASMN1; SMN2NPC1HSD17B10KDM4E | |
| SCHEMBL8767540 | 0.83 | TSHR (0.43) | RARBHSD17B10MAPTMEN1ALDH1A1 | |
| SCHEMBL9433010 | 0.82 | NPC1 (0.34) | RARBRAB9ASMN1; SMN2NPC1HSD17B10 |
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 |