Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 6/20 | 0.39 |
| ▸ | CA1 | P00915 | 6/20 | 0.39 |
| ▸ | CA2 | P00918 | 6/20 | 0.39 |
| ▸ | CA9 | Q16790 | 6/20 | 0.39 |
| ▸ | CA7 | P43166 | 5/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL9381825 | 0.80 | KDM4E (0.42) | KDM4ECA12CA1CA2CA9 | |
| SCHEMBL269086 | 0.79 | — | — | |
| SCHEMBL20138617 | 0.78 | KDM4E (0.43) | KDM4EALDH1A1MAPTMAP3K5POLB | |
| SCHEMBL6965578 | 0.75 | — | — | |
| SCHEMBL1341049 | 0.75 | — | — | |
| SCHEMBL888674 | 0.75 | KDM4E (0.55) | KDM4EALDH1A1MAP3K5 | |
| SCHEMBL2551266 | 0.74 | KDM4E (0.50) | KDM4EALDH1A1MAP3K5 | |
| SCHEMBL243257 | 0.74 | MAPT (0.50) | KDM4EALDH1A1MAPTMAP3K5POLB | |
| SCHEMBL12411796 | 0.74 | KDM4E (0.50) | KDM4EALDH1A1MAP3K5HPGD | |
| SCHEMBL16636387 | 0.72 | KDM4E (0.52) | KDM4EALDH1A1MAP3K5 |
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-107624112-B | Small molecule inhibitors of lactate dehydrogenase and methods of use thereof | 美国政府健康及人类服务部 | 2022-03-04 | — | — | CN | disclosed |