Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 10/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 10/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | PIR | O00625 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23213491 | 0.95 | LMNA (0.42) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL23212912 | 0.90 | KEAP1 (0.42) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL23213647 | 0.90 | KEAP1 (0.42) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL23210226 | 0.84 | LMNA (0.44) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL23210311 | 0.84 | LMNA (0.44) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL23209991 | 0.82 | LMNA (0.48) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL29619690 | 0.81 | MRGPRX4 (0.41) | LMNAMAPTMRGPRX4 | |
| SCHEMBL23295193 | 0.81 | MRGPRX4 (0.41) | LMNAMAPTMRGPRX4 | |
| SCHEMBL23213273 | 0.80 | KDM1A (0.40) | KEAP1NFE2L2LMNAMAPTCYP1A2 | |
| SCHEMBL23210281 | 0.79 | KDM1A (0.41) | KEAP1NFE2L2LMNAMAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021070091-A1 | 5-OXA-2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS | NOVARTIS AG (CH) | 2021-04-15 | — | — | WO | disclosed |