Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.56 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | EPRS1 | P07814 | 2/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 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 | |
|---|---|---|---|---|
| SCHEMBL30198252 | 0.84 | KEAP1 (0.59) | KEAP1NFE2L2EPRS1GPR35ALDH1A1 | |
| SCHEMBL24610989 | 0.79 | ALDH1A1 (0.43) | GPR35KMT2AALDH1A1NPC1RAB9A | |
| SCHEMBL9775923 | 0.78 | KEAP1 (0.59) | KEAP1NFE2L2EGLN1KMT2AALDH1A1 | |
| SCHEMBL2314993 | 0.74 | DHODH (0.48) | KEAP1NFE2L2GPR35GRIN1GRIN2A | |
| SCHEMBL23883052 | 0.72 | EGLN1 (0.39) | KEAP1NFE2L2AURKAEPRS1GPR35 | |
| SCHEMBL113812 | 0.72 | KEAP1 (1.00) | KEAP1NFE2L2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL29744459 | 0.72 | KEAP1 (1.00) | KEAP1NFE2L2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL9775902 | 0.72 | KEAP1 (0.56) | KEAP1NFE2L2GPR35SORT1EGLN1 | |
| SCHEMBL22743009 | 0.71 | KEAP1 (0.46) | KEAP1NFE2L2GPR35GRIN1GRIN2A | |
| Hydrochloric Acid SCHEMBL919985 | 0.71 | KEAP1 (0.96) | KEAP1NFE2L2ALDH1A1LMNASMN1; 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-3596069-B1 | KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO | SCRIPPS RESEARCH INST (US) | 2022-07-13 | — | — | EP | disclosed |