Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | YWHAG | P61981 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29324454 | 0.91 | KMT2A (0.41) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL29324385 | 0.89 | PDE4A (0.50) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL29324080 | 0.86 | POLR1A (0.40) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL31103594 | 0.80 | ALDH1A1 (0.36) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL31103664 | 0.77 | KMT2A (0.38) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL29324375 | 0.75 | PDE4A (0.47) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL31103663 | 0.70 | PDE4A (0.44) | ALDH1A1KDM4EKMT2AMEN1USP2 | |
| SCHEMBL29324061 | 0.70 | PDE4A (0.44) | ALDH1A1KDM4EKMT2AMEN1USP2 | |
| SCHEMBL31103631 | 0.68 | PDE4A (0.41) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL29324423 | 0.66 | KMT2A (0.48) | ALDH1A1KDM4EKMT2AMEN1HPGD |
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-2024151425-A1 | COMPOUNDS AND METHOD FOR TREATING HIV INFECTION | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2024-07-18 | — | — | WO | disclosed |