Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.55 |
| ▸ | MAPKAPK2 | P49137 | 4/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | ATR | Q13535 | 7/20 | 0.42 |
| ▸ | PRKDC | P78527 | 2/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30504276 | 1.00 | GRM5 (0.55) | GRM5MAPKAPK2GLAHPGDCDK5 | |
| SCHEMBL1318334 | 0.83 | GRM5 (0.51) | GRM5MAPKAPK2ATRPRKDCALDH1A1 | |
| SCHEMBL3408307 | 0.82 | ATR (0.61) | GRM5CDK5CDK5R1ATRPRKDC | |
| SCHEMBL3374259 | 0.81 | CDK5 (0.43) | GLAHPGDCDK5CDK5R1ATR | |
| SCHEMBL12343678 | 0.81 | GRM5 (0.55) | GRM5MAPKAPK2CDK5CDK5R1ATR | |
| SCHEMBL14015128 | 0.80 | HPGD (0.50) | GRM5MAPKAPK2GLAHPGDALDH1A1 | |
| SCHEMBL5684569 | 0.79 | ATR (0.63) | CDK5CDK5R1ATRPRKDC | |
| SCHEMBL11008090 | 0.78 | ALDH1A1 (0.45) | GRM5GLAHPGDCDK5CDK5R1 | |
| SCHEMBL3860081 | 0.77 | ATR (0.72) | GRM5ATRPRKDC | |
| SCHEMBL11263012 | 0.77 | MAPT (0.46) | GLAHPGDALDH1A1 |
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-3954753-A | SEDATIVES, MUSCLE RELAXANTS, ANTICONVULSANTS | HOFFMANN-LA ROCHE INC. (US) | 1976-05-04 | — | — | US | disclosed |