Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 2/20 | 0.33 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.33 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.33 |
| ▸ | ALPG | P10696 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27357933 | 0.86 | ALPL (0.34) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL27438638 | 0.79 | MAPT (0.33) | ALDH1A1ALPLPLAANR2E1ALPG | |
| SCHEMBL8772961 | 0.72 | CYP2C9 (0.50) | CYP2C9CYP2C19 | |
| SCHEMBL27651791 | 0.71 | — | — | |
| SCHEMBL27477875 | 0.71 | MAPT (0.32) | MAPTKMT2AGAA | |
| SCHEMBL27881074 | 0.69 | CYP1A2 (0.31) | MAPTCYP1A2CYP3A4CYP2D6CYP19A1 | |
| Hydrochloric Acid SCHEMBL28802458 | 0.67 | ALPL (0.37) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL28177241 | 0.67 | — | — | |
| Benzene SCHEMBL27942072 | 0.66 | SMN1; SMN2 (0.31) | ALDH1A1 | |
| SCHEMBL28796556 | 0.65 | ALPL (0.48) | PDE4APDE4BPDE4CPDE4DALPL |
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 |
|---|---|---|---|---|---|---|---|
| CN-106999479-B | Heteroaryl compounds useful as inhibitors of SUMO activating enzyme | 米伦纽姆医药公司 | 2021-07-16 | — | — | CN | disclosed |