Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.40 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.40 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.40 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 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 | |
|---|---|---|---|---|
| SCHEMBL581419 | 0.86 | CASP1 (0.53) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL7255679 | 0.83 | CASP1 (0.50) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL1752936 | 0.83 | CASP1 (0.46) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL7435124 | 0.83 | CYP2A6 (0.44) | MEN1ALDH1A1KMT2AKDM4EMAPT | |
| SCHEMBL1752896 | 0.81 | CASP1 (0.44) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL1752940 | 0.79 | CASP1 (0.45) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL1752842 | 0.78 | CASP1 (0.47) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL7438450 | 0.76 | MAPT (0.40) | CTSKSREBF2SMARCA2SMARCA4PBRM1 | |
| SCHEMBL1752910 | 0.76 | CASP1 (0.43) | CASP1SMARCA2SMARCA4PBRM1SMN1; SMN2 | |
| SCHEMBL1753114 | 0.75 | NPC1 (0.47) | CASP1SREBF2SMN1; SMN2MEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5278161-A | Racemic mixtures | HOFFMANN-LA ROCHE INC. (US) | 1994-01-11 | — | — | US | disclosed |
| EP-0464572-A2 | Aminoacid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1992-01-08 | — | — | EP | disclosed |