Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 4/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21370919 | 0.81 | ADK (0.41) | ALDH1A1LMNAALBMAPK1 | |
| SCHEMBL21371089 | 0.80 | ADK (0.42) | ALDH1A1LMNAALBMAPK1 | |
| SCHEMBL21369233 | 0.79 | ADK (0.46) | CDK1CCNB1 | |
| SCHEMBL23809777 | 0.79 | ADK (0.46) | CDK1CCNB1 | |
| SCHEMBL23809695 | 0.79 | ADK (0.46) | CYP2A6 | |
| SCHEMBL20938179 | 0.74 | ALDH1A1 (0.39) | ALDH1A1LMNAALBMAPK1 | |
| SCHEMBL23982134 | 0.73 | PRMT5 (0.44) | ALDH1A1LMNAALBMAPK1 | |
| SCHEMBL18572038 | 0.73 | PRMT5 (0.44) | ALDH1A1LMNAALBMAPK1 | |
| SCHEMBL13272701 | 0.72 | ADK (0.40) | ALDH1A1LMNAALBMAPK1CDK1 | |
| SCHEMBL23982219 | 0.70 | ALDH1A1 (0.57) | ALDH1A1LMNAALBMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3765475-B1 | SUBSTITUTED PYRIDOPYRROLOPYRIMIDINE RIBONUCLEOSIDES FOR THERAPEUTIC USES | USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR V V I (CZ) | 2021-09-15 | — | — | EP | disclosed |