Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | RRM2 | P31350 | 2/20 | 0.43 |
| ▸ | RRM1 | P23921 | 1/20 | 0.43 |
| ▸ | RRM2B | Q7LG56 | 1/20 | 0.43 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL6002151 | 0.81 | MAOA (0.46) | ALDH1A1RRM2RRM1RRM2BCISD1 | |
| SCHEMBL17666941 | 0.81 | ALDH1A1 (0.53) | ALDH1A1GAAKMT2ACTSLMAOA | |
| SCHEMBL17666943 | 0.81 | ALDH1A1 (0.53) | ALDH1A1GAAKMT2ACTSLMAOA | |
| SCHEMBL6000574 | 0.75 | POLB (0.47) | ALDH1A1GAAKMT2ACTSLMAOA | |
| SCHEMBL6002241 | 0.75 | POLB (0.47) | ALDH1A1GAAKMT2AMAOASMN1; SMN2 | |
| SCHEMBL6472216 | 0.74 | USP2 (0.51) | ALDH1A1RECQL | |
| Nicothiazone SCHEMBL27963917 | 0.74 | CTH (0.67) | GAAADORA2AMEN1KMT2ASMN1; SMN2 | |
| Nicothiazone SCHEMBL2110572 | 0.74 | CTH (0.67) | GAAADORA2AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL6002455 | 0.73 | MAOA (0.51) | ALDH1A1GAARRM2MAOASMN1; SMN2 | |
| SCHEMBL6002142 | 0.73 | HTT (0.49) | ALDH1A1GAAMEN1KMT2ACTSL |
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-1734939-A1 | ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE | The Regents of The University of California (US) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005087211-A1 | ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2005-09-22 | — | — | WO | disclosed |