Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 8/20 | 0.54 |
| ▸ | PRKCA | P17252 | 1/20 | 0.54 |
| ▸ | PDGFRA | P16234 | 11/20 | 0.50 |
| ▸ | CCNE1 | P24864 | 11/20 | 0.50 |
| ▸ | CDK2 | P24941 | 11/20 | 0.50 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3445758 | 0.93 | CDK1 (0.54) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3444620 | 0.88 | PDGFRA (0.50) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3445305 | 0.88 | PDGFRA (0.63) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3446833 | 0.87 | CDK1 (0.51) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3445975 | 0.86 | CDK1 (0.72) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3445258 | 0.86 | CDK1 (0.56) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3445365 | 0.86 | CDK2 (0.51) | CDK1CCNE1CDK2FLT3 | |
| SCHEMBL3444809 | 0.86 | CLK1 (0.55) | CDK1PRKCACCNE1CDK2 | |
| SCHEMBL3444440 | 0.86 | CDK1 (0.54) | CDK1PRKCAPDGFRACCNE1CDK2 | |
| SCHEMBL3445553 | 0.85 | CDK1 (0.51) | CDK1PRKCAPDGFRACCNE1CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7816350-B2 | Substituted [1,2,3] triazolo[4,5-D]pyrimidines as cdk inhibitors | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2010-10-19 | — | — | US | claimed |