Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | SELE | P16581 | 1/20 | 0.32 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28149801 | 0.74 | ALDH1A1 (0.39) | ALDH1A1LMNASMN1; SMN2PDE4APDE4B | |
| SCHEMBL9524365 | 0.70 | PDE4A (0.32) | PDE4APDE4BPDE4CPDE4DDYRK1A | |
| SCHEMBL83499 | 0.67 | — | — | |
| SCHEMBL12495916 | 0.67 | ALDH1A1 (0.39) | ALDH1A1LMNASMN1; SMN2SELEVCAM1 | |
| SCHEMBL15231682 | 0.67 | KMT2A (0.34) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL856427 | 0.67 | ALDH1A1 (0.39) | ALDH1A1LMNASMN1; SMN2PDE4APDE4B | |
| Hydrochloric Acid SCHEMBL31150968 | 0.67 | MPO (0.36) | ALDH1A1LMNASMN1; SMN2AXL | |
| SCHEMBL7981865 | 0.67 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL20752742 | 0.66 | NOS2 (0.44) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3322337 | 0.66 | TYMP (0.39) | ALDH1A1LMNASMN1; SMN2SELEVCAM1 |
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-2022136174-A1 | TRICYCLIC PYRIMIDINES AS CYCLIN-DEPENDENT KINASE 7 (CDK7) INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2022-06-30 | — | — | WO | disclosed |