Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | HPGDS | O60760 | 2/20 | 0.49 |
| ▸ | JAK2 | O60674 | 1/20 | 0.48 |
| ▸ | JAK1 | P23458 | 1/20 | 0.48 |
| ▸ | TYK2 | P29597 | 1/20 | 0.48 |
| ▸ | JAK3 | P52333 | 1/20 | 0.48 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.43 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18788537 | 0.93 | THRB (0.50) | THRBKDM4EMAPTHPGDSJAK2 | |
| SCHEMBL4485955 | 0.83 | ALDH1A1 (0.46) | THRBKDM4EMAPTHTTGAA | |
| SCHEMBL8550947 | 0.80 | KDM4E (0.51) | THRBKDM4EMAPTHPGDSJAK2 | |
| SCHEMBL12836454 | 0.79 | JAK3 (0.41) | THRBKDM4EMAPTJAK2JAK1 | |
| SCHEMBL9965876 | 0.79 | JAK3 (0.41) | THRBKDM4EMAPTJAK2JAK1 | |
| SCHEMBL948255 | 0.79 | GPR119 (0.53) | THRBKDM4EMAPTHPGDSJAK2 | |
| SCHEMBL2512441 | 0.78 | KDM4E (0.52) | THRBKDM4EMAPTHPGDSJAK2 | |
| SCHEMBL459905 | 0.77 | MAPT (0.51) | THRBKDM4EMAPTHPGDSJAK2 | |
| SCHEMBL2899508 | 0.77 | THRB (0.51) | THRBKDM4EMAPTHPGDSJAK2 | |
| SCHEMBL16457597 | 0.77 | KDM4E (0.51) | THRBKDM4EMAPTHPGDSJAK2 |
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-114874186-B | Glutamine acyl cyclase isozyme inhibitor and preparation method and application thereof | 深圳大学 | 2023-07-11 | — | — | CN | disclosed |
| CN-114874186-A | Glutaminyl cyclase isoenzyme inhibitor and preparation method and application thereof | 深圳大学 | 2022-08-09 | — | — | CN | disclosed |