Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.48 |
| ▸ | RAB9A | P51151 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.38 |
| ▸ | RELA | Q04206 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9433261 | 0.94 | RAB9A (0.47) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9433608 | 0.93 | RAB9A (0.46) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766342 | 0.90 | SMN1; SMN2 (0.54) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9433781 | 0.86 | KDM4C (0.36) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9433010 | 0.86 | NPC1 (0.34) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9434002 | 0.83 | RARB (0.34) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766676 | 0.83 | RAB9A (0.50) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL8766722 | 0.82 | RAB9A (0.49) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9434295 | 0.80 | NPC1 (0.41) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL9434621 | 0.80 | RARB (0.36) | SMN1; SMN2RAB9ANPC1HSD17B10L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5372746-A | Fluoro-substituted tolane compounds and liquid crystalline mixtures containing same | HOFFMANN-LA ROCHE INC. (US) | 1994-12-13 | — | — | US | disclosed |