Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 13/20 | 0.68 |
| ▸ | CDK5R1 | Q15078 | 12/20 | 0.68 |
| ▸ | CDK1 | P06493 | 6/20 | 0.68 |
| ▸ | CCNB2 | O95067 | 5/20 | 0.68 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.68 |
| ▸ | CCNB3 | Q8WWL7 | 5/20 | 0.68 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.55 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.55 |
| ▸ | CDK2 | P24941 | 4/20 | 0.55 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.55 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5466623 | 0.90 | CDK5 (0.78) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL14587744 | 0.88 | CDK1 (0.64) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL21016776 | 0.77 | CCNE2 (0.58) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL21016420 | 0.76 | AHR (0.55) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL25261612 | 0.75 | CCNK (0.55) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL30518531 | 0.75 | CCNK (0.55) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL5466080 | 0.74 | TDP1 (0.74) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL14431263 | 0.72 | CDK1 (0.57) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL14587738 | 0.72 | TDP1 (0.63) | CDK5CDK5R1CDK1CCNB2CCNB1 | |
| SCHEMBL30518552 | 0.72 | CCNK (0.60) | CDK5CDK5R1CDK1CCNB2CCNB1 |
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 |