Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAD52 | P43351 | 2/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | PTK2B | Q14289 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL28285609 | 0.88 | KDM4E (0.41) | HTR6KDM4EMAPTRAD52NCF1 | |
| SCHEMBL20784370 | 0.80 | KDM4E (0.46) | HTR6KDM4EMAPTRAD52NCF1 | |
| SCHEMBL20784335 | 0.75 | KDM4E (0.41) | HTR6KDM4EMAPTRAD52NCF1 | |
| SCHEMBL20784474 | 0.72 | NR1H2 (0.40) | HTR6KDM4EMAPTRAD52NCF1 | |
| SCHEMBL21671924 | 0.70 | ALDH1A1 (0.42) | HTR6KDM4EMAPTRAD52NCF1 | |
| SCHEMBL28284064 | 0.67 | GAA (0.45) | KDM4EMAPTNCF1GAARECQL | |
| SCHEMBL20784110 | 0.66 | KDM4E (0.54) | HTR6KDM4EMAPTRAD52NCF1 | |
| SCHEMBL188609 | 0.65 | MAPT (0.56) | KDM4EMAPTRAD52NCF1GAA | |
| SCHEMBL6981569 | 0.64 | MAPT (0.60) | KDM4EMAPTRAD52NCF1GAA | |
| SCHEMBL189132 | 0.64 | MAPT (0.59) | KDM4EMAPTRAD52NCF1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019037678-A1 | PYRAZOLO[3,4-D]PYRIMIDIN-3-ONE DERIVATIVE, PHARMACEUTICAL COMPOSITION AND USE THEREOF | 上海迪诺医药科技有限公司 | 2019-02-28 | — | — | WO | disclosed |