Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 4/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.35 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
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 SCHEMBL29732447 | 0.98 | ALOX5 (0.50) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL22721156 | 0.98 | ALOX5 (0.50) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL31172103 | 0.79 | SLC6A4 (0.61) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL28359596 | 0.79 | SLC6A4 (0.61) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL22728554 | 0.78 | SLC6A4 (0.55) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL2708963 | 0.78 | SLC6A4 (0.54) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL31412580 | 0.77 | SLC6A4 (0.50) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL7462994 | 0.77 | ALOX5 (0.51) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| SCHEMBL7462997 | 0.77 | ALOX5 (0.51) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 | |
| Hydrochloric Acid SCHEMBL22721167 | 0.77 | SLC6A4 (0.53) | ALOX5SLC6A4DRD2SLC6A3SLC6A2 |
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 |