Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.54 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8403540 | 0.86 | BRD4 (0.62) | BRD4P2RX7POLBGRM5PLK1 | |
| SCHEMBL10289971 | 0.78 | BRD4 (0.56) | BRD4P2RX7POLBGRM5PLK1 | |
| SCHEMBL10289415 | 0.78 | KDM4E (0.68) | BRD4POLBKDM4ELMNATDP1 | |
| SCHEMBL16987892 | 0.78 | BRD4 (0.56) | BRD4P2RX7POLBGRM5PLK1 | |
| SCHEMBL30380244 | 0.78 | KDM4E (0.68) | BRD4POLBKDM4ELMNATDP1 | |
| SCHEMBL8300009 | 0.78 | P2RX7 (0.70) | BRD4P2RX7POLBGRM5CNR1 | |
| SCHEMBL23376891 | 0.78 | ALDH1A1 (0.47) | P2RX7POLBGRM5KDM4EALDH1A1 | |
| SCHEMBL16481221 | 0.77 | BRD4 (0.54) | BRD4P2RX7POLBGRM5PLK1 | |
| SCHEMBL24638170 | 0.77 | BRD4 (0.54) | BRD4P2RX7POLBGRM5GAA | |
| SCHEMBL1094603 | 0.77 | GRM5 (0.59) | BRD4P2RX7POLBGRM5PLK1 |
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-3572413-B1 | 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDIN-3-ONE DERIVATIVE AS WEE1 INHIBITOR | SHIJIAZHUANG SAGACITY NEW DRUG DEV CO LTD (CN) | 2021-11-03 | — | — | EP | disclosed |