Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.37 |
| ▸ | RELA | Q04206 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30675690 | 0.88 | GAA (0.43) | GAAEPHX2SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL25766504 | 0.88 | GAA (0.43) | GAAEPHX2SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL29270789 | 0.88 | GAA (0.43) | GAAEPHX2KDM4ESMN1; SMN2NFKB1 | |
| SCHEMBL29270803 | 0.88 | GAA (0.43) | GAAEPHX2KDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL3484898 | 0.86 | EPHX2 (0.49) | GAAEPHX2KDM4EHSD17B10HTT | |
| SCHEMBL3484895 | 0.86 | EPHX2 (0.49) | GAAEPHX2KDM4EHSD17B10HTT | |
| SCHEMBL26962099 | 0.83 | GAA (0.44) | GAAEPHX2KDM4ESMN1; SMN2LMNA | |
| SCHEMBL5735937 | 0.82 | GAA (0.42) | GAAEPHX2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL5969627 | 0.82 | GAA (0.42) | GAAEPHX2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL25584629 | 0.82 | GAA (0.42) | GAAEPHX2SMN1; SMN2MEN1KMT2A |
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-116964048-A | Bicyclic tetrahydroazepine derivatives for the treatment of cancer | 豪夫迈·罗氏有限公司 | 2023-10-27 | — | — | CN | disclosed |