Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | CCR1 | P32246 | 10/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2856304 | 0.94 | KEAP1 (0.53) | KEAP1NFE2L2CCR1EPHX1KDM4E | |
| SCHEMBL2856294 | 0.92 | CCR1 (0.49) | KEAP1NFE2L2CCR1EPHX1KDM4E | |
| SCHEMBL2860715 | 0.91 | ALDH1A1 (0.46) | CCR1KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL2856556 | 0.91 | CCR1 (0.54) | CCR1 | |
| SCHEMBL2860700 | 0.90 | KEAP1 (0.46) | KEAP1NFE2L2CCR1EPHX1CHRM3 | |
| SCHEMBL2853364 | 0.89 | CCR1 (0.52) | KEAP1NFE2L2CCR1EPHX1KDM4E | |
| SCHEMBL2860247 | 0.89 | CCR1 (0.59) | CCR1KDM4EALDH1A1MAPT | |
| SCHEMBL2852454 | 0.87 | KDM4E (0.48) | CCR1KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL2857994 | 0.85 | MTOR (0.46) | CCR1KDM4EALDH1A1MAPT | |
| SCHEMBL2861243 | 0.85 | KDM4E (0.52) | KEAP1NFE2L2CCR1KDM4EALDH1A1 |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |