Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR5A | P47898 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.38 |
| ▸ | DRD3 | P35462 | 4/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31061252 | 1.00 | HTR5A (0.41) | HTR5ADRD2DRD3CHRM2CHRM1 | |
| SCHEMBL28227231 | 0.82 | DRD2 (0.36) | DRD2DRD3DRD1DRD4 | |
| SCHEMBL21255695 | 0.81 | HTR5A (0.42) | HTR5ADRD2DRD3CHRM2CHRM1 | |
| SCHEMBL1828068 | 0.77 | KDM4E (0.38) | DRD2DRD1PTGS2 | |
| SCHEMBL30203107 | 0.72 | MAOB (0.35) | — | |
| SCHEMBL20101404 | 0.72 | TRPA1 (0.33) | PNMT | |
| SCHEMBL20825133 | 0.72 | ALDH1A1 (0.42) | — | |
| SCHEMBL28228041 | 0.72 | ACHE (0.37) | HTR5APNMTADRA2A | |
| SCHEMBL12961127 | 0.71 | GABRA1 (0.36) | DRD2DRD3DRD4 | |
| SCHEMBL301029 | 0.71 | NPC1 (0.41) | HTR5ADRD2DRD3CHRM2CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4212535-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | Lg Chem, Ltd. (KR) | 2023-07-19 | — | — | EP | disclosed |