Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | SGMS1 | Q86VZ5 | 2/20 | 0.45 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 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 | |
|---|---|---|---|---|
| SCHEMBL7877387 | 0.81 | ALDH1A1 (0.55) | ALDH1A1POLBSMN1; SMN2SGMS1FLT3 | |
| SCHEMBL9021085 | 0.79 | TP53 (0.44) | ALDH1A1 | |
| SCHEMBL9020794 | 0.77 | NR1H2 (0.34) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7873796 | 0.76 | ALDH1A1 (0.53) | ALDH1A1POLBSMN1; SMN2SGMS1ALOX15B | |
| SCHEMBL7879555 | 0.75 | TDP1 (0.47) | ALDH1A1POLBSMN1; SMN2FLT3 | |
| SCHEMBL7109149 | 0.73 | ALDH1A1 (1.00) | ALDH1A1POLBSMN1; SMN2SGMS1AKR1C3 | |
| SCHEMBL9372954 | 0.72 | SIGMAR1 (0.53) | ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL7873778 | 0.71 | CYP19A1 (0.54) | ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL29260159 | 0.71 | ALDH1A1 (0.81) | ALDH1A1POLBSMN1; SMN2SGMS1AKR1C3 | |
| SCHEMBL7876919 | 0.70 | ALDH1A1 (0.46) | ALDH1A1POLBSMN1; SMN2 |
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-0705251-A1 | IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS | Knoll AG (DE) | 1996-04-10 | — | — | EP | disclosed |