Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 7/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | PHGDH | O43175 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | USP4 | Q13107 | 1/20 | 0.43 |
| ▸ | USP7 | Q93009 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29790433 | 0.85 | NAMPT (0.47) | NR1H4EPHX2NAMPTKMT2ACD274 | |
| SCHEMBL19633223 | 0.82 | NAMPT (0.43) | HDAC1HDAC6NAMPTUSP4USP7 | |
| SCHEMBL28249249 | 0.80 | NR1H4 (0.46) | NR1H4EPHX2HDAC1HDAC6PHGDH | |
| SCHEMBL5000911 | 0.79 | TOP1 (0.40) | HDAC1HDAC6NAMPTHDAC3HDAC2 | |
| SCHEMBL15385155 | 0.79 | TOP1 (0.40) | HDAC1HDAC6NAMPTHDAC3HDAC2 | |
| SCHEMBL5001090 | 0.79 | TOP1 (0.40) | HDAC1HDAC6NAMPTHDAC3HDAC2 | |
| SCHEMBL1845748 | 0.79 | MAPK14 (0.39) | HDAC1HDAC6NAMPTHDAC3HDAC2 | |
| SCHEMBL14441947 | 0.78 | HRAS (0.49) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL20086569 | 0.77 | NAMPT (0.47) | HDAC1HDAC6NAMPTKMT2AHDAC3 | |
| SCHEMBL6495067 | 0.77 | HRAS (0.52) | HDAC1HDAC6HDAC3HDAC2HDAC10 |
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-108602803-A | Piperidinobenzodiazepine compounds with antiproliferative activity | 福姆通格尼克斯有限公司 | 2018-09-28 | — | — | CN | disclosed |