Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11754838 | 0.89 | LMNA (0.50) | LMNANPC1CYP2C19CA1CA2 | |
| SCHEMBL11759687 | 0.86 | CA1 (0.40) | LMNANPC1CA1CA2CA9 | |
| SCHEMBL11762196 | 0.83 | LMNA (0.55) | LMNANPC1CYP2C19SMN1; SMN2 | |
| Fexinidazole Sulfone SCHEMBL11756026 | 0.79 | LMNA (0.54) | LMNANPC1CYP2C19CA1CA2 | |
| SCHEMBL11729587 | 0.79 | LMNA (0.51) | LMNANPC1CYP2C19CA1CA2 | |
| SCHEMBL11754642 | 0.79 | LMNA (0.51) | LMNANPC1CYP2C19KDRSMN1; SMN2 | |
| SCHEMBL11758326 | 0.79 | LMNA (0.51) | LMNANPC1CYP2C19KDREGFR | |
| SCHEMBL11754808 | 0.79 | LMNA (0.51) | LMNANPC1CYP2C19KDR | |
| SCHEMBL11641060 | 0.78 | LMNA (0.59) | LMNANPC1CYP2C19EGFRERBB2 | |
| SCHEMBL11754945 | 0.78 | LMNA (0.48) | LMNANPC1CYP2C19CA1CA2 |
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-4031232-A | 1-Alkyl-2-(phenoxymethyl)-5-nitro-imidazoles and process for their manufacture | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-06-21 | — | — | US | disclosed |