Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 13/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 13/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CCND3 | P30281 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22966560 | 0.85 | CDK4 (0.41) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL18820431 | 0.78 | CDK4 (0.42) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL18819902 | 0.75 | PDCD1 (0.52) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL21414409 | 0.75 | PNMT (0.44) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL20038575 | 0.75 | MAPT (0.39) | PDCD1CD274MAPTCYP3A4CYP2D6 | |
| SCHEMBL21451836 | 0.74 | CD274 (0.54) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL12693988 | 0.74 | CDK4 (0.43) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL21452319 | 0.73 | CDK4 (0.42) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL18291660 | 0.73 | CDK4 (0.44) | CDK4CDK2CDK6PDCD1CD274 | |
| SCHEMBL18819903 | 0.72 | CDK4 (0.42) | CDK4PDCD1CD274LMNA |
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-2019192506-A1 | IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF | BETTA PHARMACEUTICALS CO., LTD (CN) | 2019-10-10 | — | — | WO | disclosed |