Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 14/20 | 0.53 |
| ▸ | CDK2 | P24941 | 8/20 | 0.53 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.53 |
| ▸ | CCNB2 | O95067 | 5/20 | 0.53 |
| ▸ | CCNB3 | Q8WWL7 | 5/20 | 0.53 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.44 |
| ▸ | CLK1 | P49759 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 2/20 | 0.41 |
| ▸ | CCNK | O75909 | 1/20 | 0.40 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 3/20 | 0.40 |
| ▸ | CCND1 | P24385 | 3/20 | 0.40 |
| ▸ | CDK7 | P50613 | 2/20 | 0.40 |
| ▸ | CCNH | P51946 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3445956 | 1.00 | CDK1 (0.53) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3446119 | 0.92 | CDK1 (0.53) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3446125 | 0.92 | CDK1 (0.53) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3446242 | 0.89 | CDK1 (0.51) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3446243 | 0.89 | CDK1 (0.51) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3445595 | 0.89 | CDK1 (0.54) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3445310 | 0.86 | CDK2 (0.49) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3444572 | 0.85 | CDK1 (0.71) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3445903 | 0.85 | CDK2 (0.43) | CDK1CDK2CCNB1CCNB2CCNB3 | |
| SCHEMBL3446344 | 0.85 | CDK1 (0.52) | CDK1CDK2CCNB1CCNB2CCNB3 |
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 |