Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.36 |
| ▸ | TGFBR2 | P37173 | 3/20 | 0.36 |
| ▸ | AVPR1B | P47901 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | KMO | O15229 | 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 | |
|---|---|---|---|---|
| SCHEMBL9312393 | 1.00 | GRM2 (0.46) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517800 | 1.00 | GRM2 (0.46) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517797 | 1.00 | GRM2 (0.46) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517781 | 0.92 | NPC1 (0.40) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517785 | 0.92 | NPC1 (0.40) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL9311911 | 0.92 | NPC1 (0.40) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517782 | 0.92 | NPC1 (0.40) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517937 | 0.91 | GRM2 (0.36) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517941 | 0.91 | GRM2 (0.36) | GRM2NPC1TP53PKMRAB9A | |
| SCHEMBL8517939 | 0.91 | GRM2 (0.36) | GRM2NPC1TP53PKMRAB9A |
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-0475273-B1 | Liquid crystal mixture containing halogenated alcenyl compounds | MERCK PATENT GMBH (DE) | 1999-04-07 | — | — | EP | disclosed |
| US-5292452-A | Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time | HOFFMANN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0475273-A1 | Halogenated alcenyl compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1992-03-18 | — | — | EP | disclosed |