Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCDIN3D | Q7Z5W3 | 5/20 | 0.43 |
| ▸ | CDK2 | P24941 | 4/20 | 0.42 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.37 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.37 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3445601 | 0.92 | CDK2 (0.47) | BCDIN3DCDK2CCNE2CCNE1CDK1 | |
| SCHEMBL3445903 | 0.91 | CDK2 (0.43) | BCDIN3DCDK2CCNE2CCNA2CCNE1 | |
| SCHEMBL3446713 | 0.90 | CDK2 (0.41) | BCDIN3DCDK2CCNE2CCNA2CCNE1 | |
| SCHEMBL3446119 | 0.85 | CDK1 (0.53) | CDK2CCNE2CCNA2CCNE1CCNA1 | |
| SCHEMBL3446125 | 0.85 | CDK1 (0.53) | CDK2CCNE2CCNA2CCNE1CCNA1 | |
| SCHEMBL3446876 | 0.84 | POLB (0.46) | BCDIN3DCDK2CCNE2CCNA2CCNE1 | |
| SCHEMBL3446820 | 0.83 | CDK2 (0.52) | CDK2CCNE2CCNA2CCNE1CCNA1 | |
| SCHEMBL3445310 | 0.83 | CDK2 (0.49) | CDK2CCNE2CCNE1CDK1CDK5 | |
| SCHEMBL3445488 | 0.82 | PARP1 (0.38) | BCDIN3DCDK2CCNE2CCNA2CCNE1 | |
| SCHEMBL3445042 | 0.82 | CDK2 (0.58) | BCDIN3DCDK2CCNE2CCNA2CCNE1 |
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 |