Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 7/20 | 0.58 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.58 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.58 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.58 |
| ▸ | CDK2 | P24941 | 10/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | CCNE2 | O96020 | 6/20 | 0.56 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.56 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.56 |
| ▸ | CCNA1 | P78396 | 5/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.54 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.54 |
| ▸ | CLK2 | P49760 | 1/20 | 0.54 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.54 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.54 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 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 | |
|---|---|---|---|---|
| SCHEMBL14587808 | 0.91 | TDP1 (0.68) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL14587740 | 0.75 | TDP1 (0.57) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL24669662 | 0.73 | TDP1 (0.81) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| Bohemine SCHEMBL29572816 | 0.73 | CDK1 (1.00) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| Bohemine SCHEMBL1443403 | 0.73 | CDK1 (1.00) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL7112489 | 0.72 | CDK1 (0.94) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL13497833 | 0.72 | CDK5 (0.68) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL14587738 | 0.72 | TDP1 (0.63) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL31069517 | 0.71 | TDP1 (0.87) | CDK1CCNB2CCNB1CCNB3CDK2 | |
| SCHEMBL14587743 | 0.71 | CDK1 (0.85) | CDK1CCNB2CCNB1CCNB3CDK2 |
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 |