Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.45 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.45 |
| ▸ | NCF1 | P14598 | 2/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL3892348 | 0.89 | HDAC1 (0.51) | CXCR4HDAC1HDAC2CYSLTR1CYSLTR2 | |
| SCHEMBL15212024 | 0.87 | HDAC1 (0.56) | CXCR4HDAC1HDAC2CYSLTR1CYSLTR2 | |
| SCHEMBL4870435 | 0.83 | CARM1 (0.51) | CXCR4HDAC1HDAC2CYSLTR1CYSLTR2 | |
| SCHEMBL13381947 | 0.80 | HDAC1 (0.48) | CXCR4HDAC1HDAC2CYSLTR1CYSLTR2 | |
| SCHEMBL24943591 | 0.79 | CXCR4 (0.51) | CXCR4HDAC1HDAC2CYSLTR1CYSLTR2 | |
| SCHEMBL2305245 | 0.77 | PDE10A (0.50) | CYSLTR1CYSLTR2NCF1NOS2BACE1 | |
| SCHEMBL30285321 | 0.77 | PDE10A (0.50) | CYSLTR1CYSLTR2NCF1NOS2BACE1 | |
| SCHEMBL506666 | 0.77 | CYSLTR1 (0.53) | CYSLTR1CYSLTR2NCF1NOS2BACE1 | |
| SCHEMBL29899422 | 0.77 | CYSLTR1 (0.53) | CYSLTR1CYSLTR2NCF1NOS2BACE1 | |
| SCHEMBL16590469 | 0.76 | SMN1; SMN2 (0.62) | HDAC1HDAC2CYSLTR1CYSLTR2MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116874414-A | Anionic and cationic p-type amino bisphenol oxy alkali metal complex, and preparation method and application thereof | 华东理工大学 | 2023-10-13 | — | — | CN | disclosed |
| CN-116854712-A | Ethylene bridged amino bisphenol oxy alkali metal complex and preparation method and application thereof | 华东理工大学 | 2023-10-10 | — | — | CN | disclosed |
| CN-116041375-A | Nitrogen-containing heterocycle substituted hexadentate aminophenoxy rare earth complex, and preparation method and application thereof | 华东理工大学 | 2023-05-02 | — | — | CN | disclosed |
| WO-2008021745-A2 | HEPATITIS C VIRUS ENTRY INHIBITORS | ITHERX PHARMACEUTICALS, INC. (US) | 2008-02-21 | — | — | WO | disclosed |
| US-6399631-B1 | 3-AMIDO OR 3-SULFONAMIDO; EATING DISORDERS IN HUMANS, DOGS AND CATS | PFIZER INC. | 2002-06-04 | — | — | US | disclosed |