Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.66 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.66 |
| ▸ | DHODH | Q02127 | 6/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.38 |
| ▸ | FPR1 | P21462 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8443689 | 0.89 | SIGMAR1 (0.62) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL956196 | 0.88 | SIGMAR1 (0.67) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL3455799 | 0.88 | SIGMAR1 (0.67) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL3380893 | 0.88 | SIGMAR1 (0.67) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL9277437 | 0.88 | SIGMAR1 (0.67) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL3377712 | 0.87 | SIGMAR1 (0.66) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL955672 | 0.87 | SIGMAR1 (0.66) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL3455854 | 0.87 | SIGMAR1 (0.66) | SIGMAR1TMEM97DHODHKEAP1NFE2L2 | |
| SCHEMBL953780 | 0.84 | SIGMAR1 (0.83) | SIGMAR1TMEM97DHODH | |
| SCHEMBL958221 | 0.84 | SIGMAR1 (0.83) | SIGMAR1TMEM97DHODH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010066829-A1 | PROCESS FOR OBTAINING ENANTIOMERICALLY ENRICHED PYRAZOLE DERIVATIVES | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2010-06-17 | — | — | WO | disclosed |
| EP-2196458-A1 | Process for obtaining enantiomerically enriched pyrazole derivatives | Laboratorios Del. Dr. Esteve, S.A. (ES) | 2010-06-16 | — | — | EP | disclosed |