Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | XDH | P47989 | 2/20 | 0.43 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.42 |
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | GPR3 | P46089 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 3/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL24315292 | 0.78 | ADORA1 (0.48) | ADORA1ADORA2AXDHTRPV3ATR | |
| SCHEMBL399198 | 0.77 | ADORA1 (0.53) | ADORA1ADORA2AXDHATRKCNH2 | |
| SCHEMBL21770721 | 0.76 | ADORA1 (0.47) | ADORA1ADORA2AXDHTRPV3ATR | |
| SCHEMBL5542629 | 0.74 | ADORA2A (0.47) | ADORA1ADORA2AXDHKCNH2SCN10A | |
| SCHEMBL1337684 | 0.74 | DHODH (0.48) | ADORA1ADORA2AXDHATRKCNH2 | |
| SCHEMBL3728446 | 0.73 | SCN9A (0.46) | ADORA1ADORA2AXDHATRKCNH2 | |
| SCHEMBL24180475 | 0.73 | DHODH (0.49) | ADORA1ADORA2AXDHATRKCNH2 | |
| SCHEMBL3733529 | 0.72 | ADORA1 (0.46) | ADORA1ADORA2AXDHKCNH2SCN10A | |
| SCHEMBL27610710 | 0.72 | SCN9A (0.48) | ADORA1ADORA2AGPR3ALOX5APFEN1 | |
| SCHEMBL2378953 | 0.72 | ADORA1 (0.48) | ADORA1ADORA2AXDHKCNH2SCN10A |
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-1126006-A2 | Liquid crystal compounds, liquid crystal medium and liquid crystal display | MERCK PATENT GmbH (DE) | 2001-08-22 | — | — | EP | disclosed |