Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 14/20 | 0.58 |
| ▸ | ERBB2 | P04626 | 13/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | GUSB | P08236 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11834463 | 0.82 | CA1 (0.53) | EGFRERBB2GLAGUSBSMN1; SMN2 | |
| Flunidazole SCHEMBL636164 | 0.82 | MAPK1 (0.59) | EGFRERBB2GLASMN1; SMN2ALDH1A1 | |
| SCHEMBL677158 | 0.80 | GLA (0.78) | EGFRERBB2GLAGUSBALDH1A1 | |
| SCHEMBL10460758 | 0.79 | EGFR (0.48) | EGFRERBB2GLASMN1; SMN2ALDH1A1 | |
| SCHEMBL11613846 | 0.76 | GLA (0.56) | EGFRERBB2GLAGUSBALDH1A1 | |
| SCHEMBL11818029 | 0.75 | GLA (0.55) | EGFRERBB2GLAGUSBALDH1A1 | |
| SCHEMBL11616161 | 0.75 | GLA (0.55) | EGFRERBB2GLAALDH1A1MAPT | |
| SCHEMBL2558351 | 0.75 | TYMS (0.47) | EGFRERBB2SMN1; SMN2ALDH1A1 | |
| SCHEMBL11845539 | 0.74 | MAPT (0.48) | EGFRERBB2SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL11720143 | 0.74 | GLA (0.47) | EGFRERBB2GLASMN1; SMN2ALDH1A1 |
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-3941801-A | Process for preparing substituted nitroimidazoles | MERCK & CO., INC. (US) | 1976-03-02 | — | — | US | disclosed |