Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 6/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.33 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3763072 | 0.78 | PDCD1 (0.37) | KDM4EMEN1GAAKMT2AKCNH2 | |
| SCHEMBL1201536 | 0.78 | DPP4 (0.46) | — | |
| SCHEMBL3758955 | 0.78 | TRPA1 (0.35) | GABRA1GABRB2HTR1AL3MBTL1 | |
| SCHEMBL1201955 | 0.75 | ALDH1A1 (0.37) | ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL4564400 | 0.75 | GABRA1 (0.46) | GABRA1GABRB2AKR1B1ADRA2BADRA2C | |
| SCHEMBL3757718 | 0.74 | LTA4H (0.44) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL3761587 | 0.74 | CYP1A2 (0.46) | ALDH1A1KDM4EMAPTHSD17B10 | |
| SCHEMBL29900352 | 0.74 | GABRA1 (0.61) | GABRA1GABRB2AKR1B1ADRA2BADRA2C | |
| SCHEMBL2362466 | 0.74 | GABRA1 (0.61) | GABRA1GABRB2AKR1B1ADRA2BADRA2C | |
| SCHEMBL1205033 | 0.72 | ALDH1A1 (0.51) | ALDH1A1KDM4EMEN1MAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1732564-A1 | BIARYL SUBSTITUTED PYRAZINONES AS SODIUM CHANNEL BLOCKERS | Merck & Co., Inc. (US) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005097136-A1 | BIARYL SUBSTITUTED PYRAZINONES AS SODIUM CHANNEL BLOCKERS | MERCK & CO., INC. (US) | 2005-10-20 | — | — | WO | disclosed |