Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | PLK1 | P53350 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 2/20 | 0.48 |
| ▸ | CDK9 | P50750 | 2/20 | 0.48 |
| ▸ | MET | P08581 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28848659 | 0.86 | ACHE (0.67) | KDM4EALDH1A1CYP1A2HPGDACHE | |
| SCHEMBL29195654 | 0.85 | ACHE (0.46) | KDM5AKDM4EALDH1A1HPGDACHE | |
| SCHEMBL28848656 | 0.83 | ACHE (0.51) | KDM5AKDM4ECYP1A2ACHEBCHE | |
| SCHEMBL28848526 | 0.82 | ACHE (0.60) | KDM5AKDM4ECYP1A2POLBACHE | |
| SCHEMBL28848525 | 0.81 | USP8 (0.60) | KDM4EACHEBCHEPLK1BACE1 | |
| SCHEMBL28848485 | 0.80 | ACHE (0.50) | KDM5AKDM4EALDH1A1HPGDACHE | |
| SCHEMBL21335354 | 0.79 | ACHE (0.77) | KDM4EALDH1A1CYP3A4CYP2C9HPGD | |
| SCHEMBL28848517 | 0.78 | ACHE (0.49) | KDM5AKDM4EACHEBCHEPLK1 | |
| SCHEMBL28848489 | 0.78 | CDK9 (0.55) | ACHEBCHEPLK1BACE1CDK2 | |
| SCHEMBL8934550 | 0.76 | KDM4E (0.66) | KDM5AKDM4EALDH1A1CYP1A2POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114957182-B | USP8 inhibitor containing flavone skeleton structure and application thereof | 中国药科大学 | 2024-03-15 | — | — | CN | disclosed |
| CN-114957182-A | USP8 inhibitor containing flavone skeleton structure and application thereof | 中国药科大学 | 2022-08-30 | — | — | CN | disclosed |