Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.50 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12611682 | 0.97 | GAA (0.55) | GAAKDM4EHSD17B10NPSR1HPGD | |
| SCHEMBL30350771 | 0.97 | GAA (0.55) | GAAKDM4EHSD17B10NPSR1HPGD | |
| SCHEMBL27370553 | 0.85 | PTPN7 (0.63) | GAAKDM4EHSD17B10NPSR1HPGD | |
| SCHEMBL419376 | 0.83 | GAA (0.66) | GAAKDM4EHSD17B10NPSR1HPGD | |
| SCHEMBL10174322 | 0.82 | GAA (0.57) | GAAKDM4EHSD17B10NPSR1HPGD | |
| SCHEMBL18286157 | 0.82 | KMT2A (0.47) | NPSR1ALDH1A1LMNAL3MBTL1MEN1 | |
| SCHEMBL19510935 | 0.82 | BRD4 (0.55) | PDE3BPDE3AP2RY12LMNAL3MBTL1 | |
| SCHEMBL30350621 | 0.82 | BRD4 (0.55) | PDE3BPDE3AP2RY12LMNAL3MBTL1 | |
| SCHEMBL30350748 | 0.82 | BRD4 (0.55) | PDE3BPDE3AP2RY12LMNAL3MBTL1 | |
| SCHEMBL27273957 | 0.81 | PDE3B (0.52) | GAAKDM4EHSD17B10NPSR1HPGD |
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-2024115641-A1 | NONCOVALENT KEAP1-NRF2 SMALL-MOLECULE INHIBITORS | UNIVERSITY OF COPENHAGEN (DK) | 2024-06-06 | — | — | WO | disclosed |