Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL11761518 | 0.90 | LMNA (0.49) | LMNACYP2C19NPC1PTGS2KMT2A | |
| SCHEMBL11760552 | 0.88 | EGFR (0.39) | LMNACYP2C19ALDH1A1SMN1; SMN2PTGS2 | |
| SCHEMBL11760508 | 0.87 | LMNA (0.53) | LMNACYP2C19NPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11754828 | 0.82 | LMNA (0.53) | LMNAALDH1A1SMN1; SMN2PTGS2KMT2A | |
| SCHEMBL11757156 | 0.81 | LMNA (0.49) | LMNACYP2C19NPC1ALDH1A1KMT2A | |
| SCHEMBL11641060 | 0.81 | LMNA (0.59) | LMNACYP2C19NPC1ALDH1A1HTT | |
| SCHEMBL11761628 | 0.79 | PTGS2 (0.42) | LMNACYP2C19SMN1; SMN2PTGS2KMT2A | |
| Fexinidazole Sulfone SCHEMBL11756026 | 0.79 | LMNA (0.54) | LMNACYP2C19NPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11765213 | 0.79 | MAOB (0.53) | LMNASMN1; SMN2MAOBMAPTMAOA | |
| SCHEMBL11760212 | 0.79 | HTR2C (0.49) | LMNACYP2C19NPC1KMT2AMAOB |
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 |