Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14175258 | 0.85 | HDAC6 (0.41) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL1462541 | 0.85 | CA14 (0.37) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL1962792 | 0.83 | MEN1 (0.45) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL3178526 | 0.83 | ALDH1A1 (0.38) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL15725091 | 0.78 | CA14 (0.40) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL10267170 | 0.76 | CA12 (0.43) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL20989891 | 0.76 | CA14 (0.39) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL21012200 | 0.76 | CA14 (0.39) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL19302428 | 0.76 | CA14 (0.39) | CA14HDAC6HDAC1HDAC2MEN1 | |
| SCHEMBL17686995 | 0.76 | CA14 (0.39) | CA14HDAC6HDAC1HDAC2MEN1 |
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-110461848-A | COMPOUNDS AND THEIR USE IN THE TREATMENT OF SCHISTOSOMIASIS | MERCK PATENT GMBH | 2019-11-15 | — | — | CN | disclosed |