Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 16/20 | 0.46 |
| ▸ | HTR2B | P41595 | 16/20 | 0.46 |
| ▸ | HTR2A | P28223 | 15/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26625271 | 1.00 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL29966331 | 1.00 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30747194 | 0.91 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30069799 | 0.91 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL32664871 | 0.87 | PARP1 (0.41) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL29975791 | 0.87 | ESR1 (0.41) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30002807 | 0.86 | PARP1 (0.44) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30702593 | 0.86 | PARP1 (0.44) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30351677 | 0.85 | PARP1 (0.43) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30801290 | 0.85 | PARP1 (0.40) | PARP1HTR2CHTR2BHTR2AHTR3E |
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-2022206737-A1 | TETRAHYDRONAPHTHALENE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2022-10-06 | — | — | WO | disclosed |