Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 11/20 | 0.40 |
| ▸ | DRD2 | P14416 | 11/20 | 0.40 |
| ▸ | HTR2A | P28223 | 10/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22721129 | 0.98 | HTR1A (0.40) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL22721095 | 0.85 | SLC6A4 (0.40) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| Hydrochloric Acid SCHEMBL29732277 | 0.85 | SLC6A4 (0.40) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| SCHEMBL6595004 | 0.83 | HTR2C (0.47) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| SCHEMBL6594636 | 0.74 | DRD2 (0.47) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| SCHEMBL22728550 | 0.74 | DRD2 (0.47) | HTR1ADRD2HTR2AHTR2CADRA1A | |
| SCHEMBL6595010 | 0.71 | SLC6A4 (0.41) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| SCHEMBL6595014 | 0.71 | SLC6A4 (0.41) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| SCHEMBL22383808 | 0.71 | DRD2 (0.54) | HTR1ADRD2HTR2ASLC6A4SLC6A2 | |
| SCHEMBL6596677 | 0.71 | SLC6A4 (0.41) | HTR1ADRD2HTR2ASLC6A4SLC6A2 |
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-2020239073-A1 | FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-03 | — | — | WO | disclosed |