Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.60 |
| ▸ | MC4R | P32245 | 1/20 | 0.57 |
| ▸ | FAAH | O00519 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 3/20 | 0.50 |
| ▸ | CHKA | P35790 | 3/20 | 0.50 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 3/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1482500 | 1.00 | HRH3 (0.60) | HRH3MC4RFAAHDRD2CHKA | |
| SCHEMBL2227678 | 0.94 | HRH3 (0.62) | HRH3MC4RFAAHCHKA | |
| SCHEMBL20804353 | 0.92 | FAAH (0.63) | HRH3FAAHDRD2DRD3DRD4 | |
| SCHEMBL28024099 | 0.92 | FAAH (0.63) | HRH3FAAHDRD2DRD3DRD4 | |
| SCHEMBL12725366 | 0.91 | DRD2 (0.55) | HRH3MC4RFAAHDRD2CHKA | |
| SCHEMBL2227448 | 0.85 | HRH3 (0.60) | HRH3FAAH | |
| SCHEMBL27912351 | 0.85 | FAAH (0.56) | HRH3FAAHDRD2DRD3DRD4 | |
| SCHEMBL29678370 | 0.85 | HRH3 (0.60) | HRH3FAAH | |
| SCHEMBL27896883 | 0.85 | FAAH (0.54) | HRH3FAAHDRD2DRD3DRD4 | |
| SCHEMBL14661526 | 0.84 | HRH3 (0.60) | HRH3MC4RCHKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805341-B | Aromatic heterocyclic compound, and preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-114805341-A | Aromatic heterocyclic compounds and preparation method and application thereof | 上海翊石医药科技有限公司 | 2022-07-29 | — | — | CN | disclosed |