Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | MAP3K14 | Q99558 | 3/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8381988 | 1.00 | S1PR3 (0.34) | S1PR3S1PR1SLC6A3SLC6A4NPC1 | |
| SCHEMBL9312602 | 0.91 | MAPK10 (0.33) | S1PR3S1PR1SLC6A3NPC1RAB9A | |
| SCHEMBL9718529 | 0.91 | MAPK10 (0.33) | S1PR3S1PR1SLC6A3NPC1RAB9A | |
| SCHEMBL9312596 | 0.91 | MAPK10 (0.33) | S1PR3S1PR1SLC6A3NPC1RAB9A | |
| SCHEMBL9312474 | 0.90 | CHRNB1 (0.35) | S1PR3S1PR1CYP11B1CYP11B2GRIN1 | |
| SCHEMBL9313556 | 0.90 | CYP11B1 (0.36) | CYP11B1CYP11B2RXRAGRIN1GRIN2B | |
| SCHEMBL8383724 | 0.90 | CYP11B1 (0.36) | CYP11B1CYP11B2RXRAGRIN1GRIN2B | |
| SCHEMBL8380287 | 0.90 | CHRNB1 (0.35) | S1PR3S1PR1CYP11B1CYP11B2GRIN1 | |
| SCHEMBL9313858 | 0.86 | RAB9A (0.37) | S1PR3S1PR1SLC6A3NPC1RAB9A | |
| SCHEMBL8382655 | 0.86 | S1PR3 (0.36) | S1PR3S1PR1SLC6A3SLC6A4NPC1 |
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-5292452-A | Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time | HOFFMANN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |