Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 11/20 | 0.55 |
| ▸ | CA2 | P00918 | 11/20 | 0.55 |
| ▸ | CA9 | Q16790 | 11/20 | 0.55 |
| ▸ | CA12 | O43570 | 8/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4280875 | 0.92 | CA1 (0.51) | CA1CA2CA9CA12LMNA | |
| SCHEMBL8515795 | 0.75 | ALDH1A1 (0.47) | CA1CA2CA9CA12LMNA | |
| SCHEMBL8514476 | 0.75 | LMNA (0.47) | CA1CA2CA9CA12LMNA | |
| SCHEMBL9612686 | 0.74 | MAOB (0.56) | LMNASMN1; SMN2ALDH1A1TSHRPOLB | |
| SCHEMBL9612685 | 0.74 | ALDH1A1 (0.52) | CA1CA2CA9CA12LMNA | |
| Dtp-348 SCHEMBL15312833 | 0.72 | CA1 (1.00) | CA1CA2CA9CA12LMNA | |
| SCHEMBL15312909 | 0.72 | CA1 (0.76) | CA1CA2CA9CA12LMNA | |
| SCHEMBL4274127 | 0.72 | NPC1 (0.49) | CA1CA2CA9CA12LMNA | |
| SCHEMBL9887933 | 0.71 | CA1 (0.59) | CA1CA2CA9CA12LMNA | |
| SCHEMBL9887862 | 0.69 | PGR (0.38) | SMN1; SMN2ALDH1A1TSHRPOLBGLA |
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-2085394-B1 | Metronidazole derivatives as antiparasitic agents | UNIV JORDAN (JO) | 2012-06-06 | — | — | EP | disclosed |
| EP-2085394-A2 | Metronidazole derivatives as antiparasitic agents | Legal Affairs Office University of Jordan (JO) | 2009-08-05 | — | — | EP | disclosed |