Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | COPS5 | Q92905 | 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 | |
|---|---|---|---|---|
| SCHEMBL28724330 | 1.00 | KDM4E (0.41) | KDM4EMAPTATAD2CCR1CCR8 | |
| SCHEMBL1161526 | 0.82 | KDM4E (0.43) | KDM4EMAPTCYP1A2NR4A2NPC1 | |
| SCHEMBL11985966 | 0.79 | NPC1 (0.44) | KDM4EMAPTATAD2CCR1CCR8 | |
| SCHEMBL14205600 | 0.77 | MET (0.41) | KDM4EMAPTATAD2CCR1CCR8 | |
| SCHEMBL13676646 | 0.77 | KDM4E (0.38) | KDM4EMAPTATAD2CCR1CCR8 | |
| SCHEMBL13676597 | 0.77 | KDM4E (0.38) | KDM4EMAPTATAD2CCR1CCR8 | |
| SCHEMBL29363534 | 0.76 | L3MBTL1 (0.41) | KDM4EMAPTCCR1CCR8CYP1A2 | |
| SCHEMBL243422 | 0.76 | HTT (0.45) | KDM4EMAPTATAD2CCR1CCR8 | |
| SCHEMBL28724331 | 0.76 | L3MBTL1 (0.41) | KDM4EMAPTCCR1CCR8CYP1A2 | |
| SCHEMBL12121755 | 0.75 | L3MBTL1 (0.44) | KDM4EMAPTCCR1CCR8CYP1A2 |
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-2022017368-A1 | DNA-PK SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 首药控股(北京)股份有限公司 | 2022-01-27 | — | — | WO | disclosed |