Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23399544 | 0.92 | CDK8 (0.35) | CDK8CNR1CNR2ALDH1A1MAPT | |
| SCHEMBL23402504 | 0.88 | CDK8 (0.41) | CDK8CNR1CNR2ALDH1A1LMNA | |
| SCHEMBL23402401 | 0.87 | USP2 (0.43) | ALDH1A1MAPTMAPK1GAALMNA | |
| SCHEMBL23401004 | 0.85 | ALDH1A1 (0.40) | CNR1CNR2ALDH1A1MAPTLMNA | |
| SCHEMBL23401654 | 0.84 | RIPK2 (0.50) | ALDH1A1MAPTLMNAUSP2TP53 | |
| SCHEMBL23400804 | 0.84 | ALDH1A1 (0.38) | ALDH1A1MAPTMAPK1GAALMNA | |
| SCHEMBL23398437 | 0.82 | PDE4A (0.38) | CDK8ALDH1A1MAPTMAPK1GAA | |
| SCHEMBL23403648 | 0.82 | ALDH1A1 (0.40) | ALDH1A1MAPTMAPK1GAALMNA | |
| SCHEMBL23401356 | 0.82 | CACNA1H (0.36) | CDK8CNR1CNR2ALDH1A1MAPT | |
| SCHEMBL23399895 | 0.80 | CYP2C9 (0.41) | CDK8CNR1CNR2ALDH1A1MAPT |
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-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |