Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 12/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 10/20 | 0.51 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.51 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.51 |
| ▸ | CDK9 | P50750 | 3/20 | 0.51 |
| ▸ | CDK7 | P50613 | 2/20 | 0.51 |
| ▸ | CCNH | P51946 | 2/20 | 0.51 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.48 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.48 |
| ▸ | CDK1 | P06493 | 5/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3445423 | 0.91 | CDK2 (0.60) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3446307 | 0.89 | CDK2 (0.49) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3445813 | 0.87 | CDK2 (0.50) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3445703 | 0.86 | CDK2 (0.60) | CDK2CCNE1CDK5CDK5R1CDK9 | |
| SCHEMBL3446446 | 0.84 | CDK2 (0.43) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3445015 | 0.83 | CDK2 (0.43) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL6201910 | 0.83 | ALDH1A1 (0.49) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3446345 | 0.82 | CDK1 (0.57) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3446343 | 0.82 | CDK1 (0.57) | CDK2CCNE1CDK5CDK5R1CCNT1 | |
| SCHEMBL3444995 | 0.82 | CCNE1 (0.51) | CDK2CCNE1CDK5CDK5R1CCNT1 |
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 |