Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 10/20 | 0.63 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.63 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.63 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.63 |
| ▸ | CDK2 | P24941 | 16/20 | 0.62 |
| ▸ | CCNE1 | P24864 | 12/20 | 0.62 |
| ▸ | CDK5 | Q00535 | 10/20 | 0.62 |
| ▸ | CDK9 | P50750 | 8/20 | 0.62 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.62 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.62 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.62 |
| ▸ | CDK7 | P50613 | 8/20 | 0.56 |
| ▸ | CCNH | P51946 | 6/20 | 0.56 |
| ▸ | CDK4 | P11802 | 4/20 | 0.55 |
| ▸ | CCND1 | P24385 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.54 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL786759 | 0.86 | CDK2 (0.74) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL786760 | 0.86 | CDK2 (0.74) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL15117670 | 0.80 | CDK2 (0.73) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL15118052 | 0.79 | CDK2 (0.73) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL15117893 | 0.78 | CDK2 (0.79) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL786103 | 0.77 | CDK2 (0.69) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL786102 | 0.77 | CDK2 (0.69) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL15117672 | 0.77 | CDK2 (0.61) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| SCHEMBL15117821 | 0.77 | CDK2 (0.68) | CDK1CCNB1CCNB2CCNB3CDK2 | |
| Olomoucine Ii SCHEMBL786673 | 0.77 | CDK2 (1.00) | CDK1CCNB1CCNB2CCNB3CDK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2438068-A1 | SUBSTITUTED 6-(2-HYDROXYBENZYLAMINO)PURINE DERIVATIVES, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THESE DERIVATIVES | Univerzita Palackého v Olomouci (CZ) | 2012-04-11 | — | — | EP | disclosed |
| WO-2010139289-A1 | SUBSTITUTED 6-(2-HYDROXYBENZYLAMINO)PURINE DERIVATIVES, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THESE DERIVATIVES | UNIVERZITA PALACKEHO V OLOMOUCI (CZ) | 2010-12-09 | — | — | WO | disclosed |