Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | GMNN | O75496 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | HBB | P68871 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | BBOX1 | O75936 | 3/20 | 0.43 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL214687 | 0.91 | KDM4E (0.62) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| SCHEMBL218933 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| Potassium Ion SCHEMBL8715930 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| SCHEMBL11359480 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| SCHEMBL2524420 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| SCHEMBL2521157 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| Lithium Ion SCHEMBL1458081 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| Silver SCHEMBL218931 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| SCHEMBL2288874 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR | |
| SCHEMBL29265998 | 0.91 | KDM4E (0.53) | KDM4EMAPTALOX15ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-118184583-A | Bisimidazole organic ligand, metal organic framework material, preparation method and application | 北京化工大学 | 2024-06-14 | — | — | CN | disclosed |