Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.40 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.35 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL11374552 | 0.79 | ABL1 (0.53) | KDM4ETP53CHRNA10CHRNA9POLB | |
| SCHEMBL9778371 | 0.72 | MAOB (0.48) | KDM4ETP53ALDH1A1CHEK1MAOB | |
| SCHEMBL9778249 | 0.72 | MAPKAPK2 (0.48) | KDM4EALDH1A1POLBMAOBHPGD | |
| SCHEMBL9778252 | 0.72 | MAOB (0.48) | KDM4EALDH1A1CHEK1MAOBHPGD | |
| SCHEMBL30008614 | 0.71 | ADRB1 (0.44) | KDM4ETP53ALDH1A1MAOBNOTUM | |
| SCHEMBL31415059 | 0.71 | ADRB1 (0.44) | KDM4ETP53ALDH1A1MAOBNOTUM | |
| SCHEMBL9360138 | 0.71 | MAPT (0.71) | KDM4EALDH1A1POLBMAOBHPGD | |
| SCHEMBL10418529 | 0.68 | MEN1 (0.44) | KDM4EALDH1A1MAOBNPC1GLA | |
| SCHEMBL17876412 | 0.67 | KDM4E (0.67) | KDM4ETP53ALDH1A1CYP2A6CHRNA10 | |
| SCHEMBL4661651 | 0.67 | MAPT (0.64) | KDM4EALDH1A1POLBMAOBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-114920753-B | 6-fluoro-dihydropyran [2,3-c ] pyrazole derivative and synthetic method and application thereof | 华南理工大学 | 2023-06-20 | — | — | CN | disclosed |