Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 1/20 | 0.30 |
| ▸ | USP9X | Q93008 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26542931 | 0.86 | NOTUM (0.48) | HDAC1HDAC2NAMPTPDK2NOTUM | |
| SCHEMBL14861328 | 0.85 | PDK2 (0.45) | HDAC1HDAC2NAMPTPDK2NOTUM | |
| SCHEMBL31348202 | 0.84 | HDAC1 (0.44) | HDAC1HDAC2NAMPTPDK2NOTUM | |
| SCHEMBL17624333 | 0.81 | HDAC1 (0.42) | HDAC1HDAC2NAMPTKDM1ATSHR | |
| SCHEMBL20364273 | 0.80 | PDK2 (0.41) | HDAC1HDAC2NAMPTPDK2KDM1A | |
| SCHEMBL26075398 | 0.80 | HDAC1 (0.39) | HDAC1HDAC2NAMPTPDK2KDM1A | |
| SCHEMBL15152898 | 0.78 | PDK2 (0.54) | PDK2SLC6A9 | |
| SCHEMBL15524327 | 0.77 | KDM1A (0.39) | KDM1AUSP9X | |
| SCHEMBL25111471 | 0.75 | NOTUM (0.50) | NAMPTPDK2NOTUMALDH1A1 | |
| SCHEMBL29079151 | 0.75 | PDK2 (0.45) | NAMPTPDK2SLC6A9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022206730-A1 | PYRIMIDOPYRAZINE COMPOUND AND USE THEREOF | 武汉人福创新药物研发中心有限公司 | 2022-10-06 | — | — | WO | disclosed |
| CN-115141202-A | Pyrimidopyrazinone compounds and uses thereof | 武汉人福创新药物研发中心有限公司 | 2022-10-04 | — | — | CN | disclosed |