Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8077099 | 0.92 | POLB (0.35) | NPC1RAB9APOLBAKR1C3AKR1C1 | |
| SCHEMBL8920660 | 0.84 | NPC1 (0.35) | NPC1RAB9APOLBAKR1C3AKR1C1 | |
| SCHEMBL8918246 | 0.82 | KCNH2 (0.36) | NPC1RAB9APOLBAKR1C3AKR1C1 | |
| SCHEMBL7752946 | 0.82 | POLB (0.31) | POLB | |
| SCHEMBL8917063 | 0.81 | NPC1 (0.37) | NPC1RAB9APOLBAKR1C3AKR1C1 | |
| SCHEMBL8916577 | 0.79 | KDM4E (0.33) | NPC1RAB9APOLBAKR1C3AKR1C1 | |
| SCHEMBL7750933 | 0.76 | ALDH1A1 (0.41) | NPC1RAB9APOLBALDH1A1L3MBTL1 | |
| SCHEMBL7755497 | 0.74 | ESR2 (0.37) | — | |
| SCHEMBL8079201 | 0.74 | POLB (0.37) | NPC1RAB9APOLBAKR1C3AKR1C1 | |
| SCHEMBL8731015 | 0.73 | LMNA (0.32) | — |
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-5595686-A | Silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1997-01-21 | — | — | US | disclosed |
| EP-0699683-A1 | Novel silacyclohexane compounds a liquid crystal composition comprising the same and a liquid crystal device comprising the composition | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-03-06 | — | — | EP | disclosed |