Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 7/20 | 0.64 |
| ▸ | CDK5 | Q00535 | 5/20 | 0.64 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.64 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.64 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.64 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.64 |
| ▸ | CCNE2 | O96020 | 9/20 | 0.60 |
| ▸ | CCNE1 | P24864 | 9/20 | 0.60 |
| ▸ | CDK2 | P24941 | 9/20 | 0.60 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.60 |
| ▸ | CCNA1 | P78396 | 6/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL5466725 | 0.89 | CDK5 (0.81) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL14587739 | 0.88 | CDK5 (0.68) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL28459824 | 0.82 | CDK1 (0.79) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL27560688 | 0.82 | CDK2 (0.61) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL21016776 | 0.80 | CCNE2 (0.58) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL21016420 | 0.79 | AHR (0.55) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL14587742 | 0.78 | TDP1 (0.67) | CDK1CDK5CCNB2CCNB1CCNB3 | |
| SCHEMBL5466623 | 0.77 | CDK5 (0.78) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL5466080 | 0.77 | TDP1 (0.74) | CDK1CDK5CDK5R1CCNB2CCNB1 | |
| SCHEMBL28461067 | 0.76 | CDK2 (0.66) | CDK1CDK5CCNE2CCNE1CDK2 |
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-7176312-B2 | Kinase inhibitor scaffolds and methods for their preparation | THE SCRIPPS RESEARCH INSTITUTE (US) | 2007-02-13 | — | — | US | disclosed |