Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1558847 | 0.88 | KDM4E (0.46) | KDM4EMAPTRAD52DRD1ADRA2C | |
| SCHEMBL30561532 | 0.88 | KDM4E (0.46) | KDM4EMAPTRAD52DRD1ADRA2C | |
| Hydrochloric Acid SCHEMBL1557318 | 0.87 | KDM4E (0.48) | KDM4EMAPTRAD52DRD1ADRA2C | |
| SCHEMBL21641752 | 0.82 | CYP2D6 (0.33) | KDM4EOPRD1OPRK1OPRM1GRIN2D | |
| SCHEMBL24124011 | 0.81 | KDM4E (0.48) | KDM4EGRIN1GRIN2AMAOAMAOB | |
| SCHEMBL25932938 | 0.79 | KDM4E (0.47) | KDM4EDRD1OPRD1OPRK1OPRM1 | |
| SCHEMBL25675778 | 0.77 | KDM4E (0.44) | KDM4EDRD1ALDH1A1MAOAMAOB | |
| SCHEMBL26408039 | 0.77 | KDM4E (0.44) | KDM4EDRD1ALDH1A1DRD2HTR2A | |
| SCHEMBL17383970 | 0.77 | MAOA (0.48) | KDM4EDRD1MAOAMAOBDRD2 | |
| SCHEMBL29391669 | 0.77 | MAOA (0.48) | KDM4EDRD1MAOAMAOBDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3604306-A1 | MACROCYCLIC DERIVATIVE OF PYRAZOL[3,4-D]PYRIMIDIN-3-ONE, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai de Novo Pharmatech Co., Ltd. (CN) | 2020-02-05 | — | — | EP | disclosed |