Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 12/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | MPI | P34949 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30953677 | 0.90 | KDM4E (0.61) | ADORA1KDM4EALDH1A1LMNAGAA | |
| SCHEMBL30953875 | 0.82 | KDM4E (0.52) | ADORA1KDM4EALDH1A1LMNAGAA | |
| SCHEMBL30953763 | 0.80 | KDM4E (0.65) | ADORA1KDM4EALDH1A1LMNAGAA | |
| SCHEMBL30953632 | 0.80 | KDM4E (0.65) | ADORA1KDM4EALDH1A1LMNAGAA | |
| SCHEMBL30953825 | 0.76 | KDM4E (0.60) | ADORA1KDM4EALDH1A1LMNAGAA | |
| SCHEMBL15075787 | 0.76 | KDM4E (0.56) | ADORA1KDM4EALDH1A1LMNAGAA | |
| SCHEMBL9206837 | 0.76 | KDM4E (1.00) | ADORA1KDM4EALDH1A1LMNAGAA | |
| Iodide SCHEMBL3994593 | 0.76 | ADORA1 (1.00) | ADORA1KDM4EALDH1A1MAPTMPI | |
| SCHEMBL1815237 | 0.76 | ADORA1 (0.97) | ADORA1KDM4EALDH1A1MAPTMPI | |
| Bromide SCHEMBL2762927 | 0.75 | ADORA1 (0.95) | ADORA1KDM4EALDH1A1LMNAMAPT |
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-2024140431-A1 | COMPOUNDS COMPRISING HETEROARYL RINGS AND COMPOSITIONS AND METHODS THEREOF | IONGEN THERAPEUTICS CO., LTD. (CN) | 2024-07-04 | — | — | WO | disclosed |