Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 3/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | CLK2 | P49760 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4297736 | 0.68 | CHEK1 (0.67) | PDE3BPDE3AKDM4ENR4A2CHEK1 | |
| SCHEMBL15471844 | 0.68 | PARP10 (0.51) | PARP1KDM4EF7F3PARP10 | |
| SCHEMBL4292026 | 0.68 | KDM4E (0.42) | PARP1PIM1MAPK8KDM4ENR4A2 | |
| SCHEMBL522217 | 0.67 | GAA (0.46) | MAPTPDE3BPDE3AKDM4ENR4A2 | |
| SCHEMBL8526291 | 0.67 | HTR2A (0.41) | JAK2MAPTNR4A2ALDH1A1 | |
| SCHEMBL15543978 | 0.66 | GAA (0.43) | MAPTKDM4ENR4A2ALDH1A1HPGD | |
| SCHEMBL5025798 | 0.66 | KDM4E (0.35) | GSK3BCDK4CCND1PDE3BPDE3A | |
| SCHEMBL15814207 | 0.65 | PARP1 (0.41) | PARP1KDRMAPTKDM4EADRA1D | |
| SCHEMBL4293070 | 0.64 | KDM4E (0.38) | GSK3BCDK4CCND1MAPK1MAPT | |
| SCHEMBL15814409 | 0.63 | EED (0.36) | PARP1MAPTKDM4ESERPINH1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007008502-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2007-01-18 | — | — | WO | disclosed |