Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8884724 | 0.78 | KDM4E (0.41) | POLBALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL7199150 | 0.78 | ACHE (0.61) | BACE1POLBALDH1A1KDM4EHPGD | |
| SCHEMBL50940 | 0.77 | GPR3 (0.58) | GPR3BACE1POLBALDH1A1KDM4E | |
| SCHEMBL31678400 | 0.77 | GPR3 (0.58) | GPR3BACE1POLBALDH1A1KDM4E | |
| SCHEMBL5510470 | 0.77 | PDE10A (0.37) | GPR3ALDH1A1KDM4EHPGDHSD17B10 | |
| Iodide SCHEMBL10805793 | 0.75 | GPR3 (0.56) | GPR3BACE1POLBALDH1A1KDM4E | |
| SCHEMBL1556594 | 0.72 | CYP1A2 (0.41) | ALDH1A1KDM4EHPGDHSD17B10MAOA | |
| SCHEMBL8390746 | 0.70 | GPR3 (0.50) | GPR3BACE1POLBALDH1A1KDM4E | |
| SCHEMBL15131690 | 0.69 | GPR3 (0.54) | GPR3BACE1POLBALDH1A1KDM4E | |
| SCHEMBL28496768 | 0.68 | CYP1A2 (0.33) | GPR3HPGDHSD17B10CASP1CASP7 |
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-112409241-B | Organic compound, application thereof and organic electroluminescent device using same | 清华大学 | 2023-04-25 | — | — | CN | disclosed |