Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.31 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29344706 | 0.85 | CDK2 (0.37) | CDK2PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL29344761 | 0.83 | CDK2 (0.35) | CDK2PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL1370649 | 0.83 | CDK2 (0.40) | CDK2PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL13650606 | 0.71 | ALDH1A1 (0.44) | CDK2PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL5119212 | 0.70 | PDE10A (0.40) | CDK2PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL12953072 | 0.70 | PDE10A (0.46) | CDK2PDE10AKDM4EALDH1A1MAPT | |
| SCHEMBL20971704 | 0.69 | MAPT (0.54) | CDK2KDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL26974008 | 0.69 | CDK2 (0.40) | CDK2KDM4EALDH1A1MAPTCDK5 | |
| SCHEMBL17625103 | 0.69 | CDK2 (0.40) | CDK2CDK5CDK5R1GSK3B | |
| SCHEMBL23181597 | 0.68 | KDM4E (0.40) | CDK2KDM4EALDH1A1MAPTRAB9A |
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-2023001061-A1 | CDK7 SELECTIVE INHIBITORS AS ANTICANCER AGENTS | JINGRUI BIOPHARMA CO., LTD. (CN) | 2023-01-26 | — | — | WO | disclosed |