Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 16/20 | 0.46 |
| ▸ | HTR2B | P41595 | 16/20 | 0.46 |
| ▸ | HTR2A | P28223 | 15/20 | 0.46 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL30747194 | 1.00 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2ACRBN | |
| SCHEMBL29966514 | 0.91 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL29966331 | 0.91 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL26625271 | 0.91 | PARP1 (0.46) | PARP1HTR2CHTR2BHTR2AHTR3E | |
| SCHEMBL30747124 | 0.89 | PARP1 (0.44) | PARP1HTR2CHTR2BHTR2ACRBN | |
| SCHEMBL5863984 | 0.89 | HTR6 (0.42) | HTR2CHTR2BHTR2ACRBNITGB3 | |
| SCHEMBL7230195 | 0.88 | ITGB3 (0.43) | HTR2CHTR2BHTR2ACRBNITGB3 | |
| SCHEMBL30747080 | 0.85 | HTR2C (0.41) | PARP1HTR2CHTR2BHTR2ACRBN | |
| SCHEMBL21008766 | 0.81 | PARP1 (0.49) | PARP1HTR2CHTR2BHTR2ACRBN | |
| SCHEMBL16382727 | 0.81 | PARP1 (0.49) | PARP1HTR2CHTR2BHTR2ACRBN |
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-2022237904-A1 | NAPHTHALENE RING-CONTAINING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF | 江苏亚虹医药科技股份有限公司 | 2022-11-17 | — | — | WO | disclosed |