Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 3/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | CTSD | P07339 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | EDNRB | P24530 | 1/20 | 0.40 |
| ▸ | EDNRA | P25101 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19393444 | 0.93 | MCL1 (0.45) | HTR7MCL1CTSDBACE1GRIA1 | |
| SCHEMBL15870792 | 0.89 | ENPP3 (0.46) | HTR7MCL1CTSDBACE1GRIA1 | |
| SCHEMBL19942893 | 0.89 | HTR7 (0.43) | HTR7MCL1CTSDBACE1GRIA1 | |
| SCHEMBL21250647 | 0.88 | ESR2 (0.47) | HTR7MCL1CTSDBACE1GRIA1 | |
| SCHEMBL22211041 | 0.87 | ENPP3 (0.45) | HTR7MCL1CTSDBACE1GRIA1 | |
| SCHEMBL16385673 | 0.87 | SLC6A9 (0.38) | HTR7MCL1CTSDBACE1ALDH1A1 | |
| SCHEMBL22698813 | 0.87 | HTR7 (0.55) | HTR7MCL1CTSDBACE1GRIA1 | |
| SCHEMBL17881830 | 0.86 | MAPT (0.39) | HTR7MCL1CTSDBACE1EDNRB | |
| SCHEMBL22079657 | 0.85 | MEN1 (0.41) | BACE1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22079983 | 0.85 | MEN1 (0.41) | BACE1ALDH1A1CYP1A2CYP3A4CYP2D6 |
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-3018120-B1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, ORGANIC ELECTROLUMINESCENT DEVICE, AND ELECTRONIC EQUIPMENT | IDEMITSU KOSAN CO (JP) | 2020-04-15 | — | — | EP | disclosed |