Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 2/20 | 1.00 |
| ▸ | HCAR3 | P49019 | 6/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | GLA | P06280 | 1/20 | 0.67 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 3/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | CDC25A | P30304 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11269607 | 0.87 | CDC25B (0.78) | CDC25BHCAR3KDM4EGLAMAPT | |
| SCHEMBL1466985 | 0.87 | CDC25B (0.77) | CDC25BHCAR3KDM4EGLAHPSE | |
| SCHEMBL28566156 | 0.87 | CDC25B (0.77) | CDC25BHCAR3KDM4EGLAHPSE | |
| Methyl Alcohol SCHEMBL28201372 | 0.86 | CDC25B (0.76) | CDC25BHCAR3KDM4EGLAMAPT | |
| SCHEMBL1465906 | 0.85 | CDC25B (0.73) | CDC25BHCAR3KDM4EGLAHPSE | |
| SCHEMBL321911 | 0.84 | HCAR3 (1.00) | CDC25BHCAR3MEN1KMT2A | |
| SCHEMBL28550092 | 0.84 | CDC25B (0.72) | CDC25BHCAR3KDM4EGLAHPSE | |
| SCHEMBL5216739 | 0.83 | CDC25B (0.71) | CDC25BKDM4EGLAHPSEPOLB | |
| SCHEMBL28553748 | 0.83 | CDC25B (0.70) | CDC25BHCAR3KDM4EGLAHPSE | |
| Hydrochloric Acid SCHEMBL321637 | 0.83 | HCAR3 (0.97) | CDC25BHCAR3MEN1KMT2A |
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-2000050419-A1 | SUBSTITUTED BICYCLIC HETEROCYCLES AND THE USE THEREOF AS THROMBIN INHIBITORS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2000-08-31 | — | — | WO | disclosed |