Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.41 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9850775 | 1.00 | CYP3A4 (0.51) | CYP3A4CYP2D6NR5A1SOAT1MEN1 | |
| SCHEMBL16809049 | 0.93 | NPC1 (0.43) | CYP3A4CYP2D6MEN1MAPTKMT2A | |
| SCHEMBL461500 | 0.87 | GABRP (0.41) | CYP3A4CYP2D6MEN1MAPTKMT2A | |
| SCHEMBL16425598 | 0.80 | CYP3A4 (0.52) | CYP3A4CYP2D6NR5A1SOAT1MEN1 | |
| SCHEMBL13412644 | 0.80 | CYP3A4 (0.52) | CYP3A4CYP2D6NR5A1SOAT1MEN1 | |
| SCHEMBL3721726 | 0.79 | MAPT (0.52) | MAPTMAPK1GABRPGABRDGABRA1 | |
| SCHEMBL7882592 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2D6NR5A1SOAT1MEN1 | |
| SCHEMBL9850826 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2D6NR5A1MEN1MAPT | |
| SCHEMBL12173063 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2D6NR5A1MEN1MAPT | |
| SCHEMBL9850739 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2D6NR5A1MEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0409634-A2 | Liquid crystal compounds and optically active compounds | SANYO CHEMICAL INDUSTRIES LTD. (JP) | 1991-01-23 | — | — | EP | disclosed |