Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | RGS4 | P49798 | 2/20 | 0.41 |
| ▸ | RGS8 | P57771 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | CTSG | P08311 | 1/20 | 0.38 |
| ▸ | CMA1 | P23946 | 1/20 | 0.38 |
| ▸ | CTRC | Q99895 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | COMT | P21964 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25685423 | 0.86 | MAPT (0.43) | RGS4RGS8MAPTTP53ELANE | |
| SCHEMBL25669483 | 0.82 | MGLL (0.41) | ALDH1A1MAPTTP53DRD2MGLL | |
| SCHEMBL20644611 | 0.77 | MAPT (0.39) | RGS4RGS8MAPTTP53ELANE | |
| SCHEMBL17664675 | 0.76 | RGS4 (0.47) | ALDH1A1RGS4RGS8ELANEF2 | |
| SCHEMBL9038067 | 0.75 | DRD2 (0.59) | ALDH1A1MAPTTP53GAADRD2 | |
| SCHEMBL18686733 | 0.74 | TYR (0.41) | ALDH1A1GSK3AGSK3BMGLL | |
| SCHEMBL14889068 | 0.70 | MAPT (0.39) | ALDH1A1MAPTTP53GAAMGLL | |
| SCHEMBL27471807 | 0.70 | DRD2 (0.37) | ALDH1A1MAPTTP53GAADRD2 | |
| SCHEMBL25160611 | 0.70 | PPARD (0.46) | RGS4RGS8TP53LMNA | |
| SCHEMBL8949571 | 0.69 | ADRB2 (0.46) | MAPTDRD2MGLLDRD3 |
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-2023109883-A1 | AROMATIC HETEROCYCLE-SUBSTITUTED COMPOUNDS, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翊石医药科技有限公司 | 2023-06-22 | — | — | WO | disclosed |
| EP-3397629-B1 | METALLOENZYME INHIBITOR COMPOUNDS | NQP 1598 LTD (KY) | 2023-04-19 | — | — | EP | disclosed |