Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 9/20 | 0.49 |
| ▸ | DRD1 | P21728 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | DRD5 | P21918 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.43 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30778391 | 0.85 | HRH1 (0.47) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL4344154 | 0.85 | HRH1 (0.47) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL531084 | 0.82 | PTGS2 (0.54) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL5478147 | 0.78 | HPGD (0.50) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL5478146 | 0.78 | HPGD (0.50) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL28353997 | 0.78 | HRH1 (0.44) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL1345320 | 0.76 | HRH1 (0.51) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL27644538 | 0.75 | HPGD (0.51) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL11607227 | 0.75 | HPGD (0.47) | HRH1DRD1DRD2DRD4DRD5 | |
| SCHEMBL7597025 | 0.75 | HPGD (0.51) | HRH1DRD1DRD2DRD4DRD5 |
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-2020036314-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME | 주식회사 엘지화학 | 2020-02-20 | — | — | WO | disclosed |