Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 4/20 | 0.41 |
| ▸ | CDK2 | P24941 | 4/20 | 0.41 |
| ▸ | CDK9 | P50750 | 4/20 | 0.41 |
| ▸ | CDK3 | Q00526 | 3/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.41 |
| ▸ | GSK3A | P49840 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21452616 | 1.00 | CDK1 (0.41) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21434066 | 1.00 | CDK1 (0.41) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21433951 | 1.00 | CDK1 (0.41) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21433953 | 1.00 | CDK1 (0.41) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21452730 | 0.96 | CDK9 (0.42) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21433986 | 0.96 | CDK9 (0.42) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21434007 | 0.96 | CDK9 (0.42) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21433984 | 0.96 | CDK9 (0.42) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21433996 | 0.94 | EPHX2 (0.43) | CDK1CDK2CDK9CDK3CDK5 | |
| SCHEMBL21433913 | 0.94 | EPHX2 (0.39) | CDK1CDK2CDK9CDK3CDK5 |
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-2019193516-A2 | SUBSTITUTED PYRIDINE AND PYRIMIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2019-10-10 | — | — | WO | disclosed |