Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | PDE4A | P27815 | 1/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 7/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | USP2 | O75604 | 3/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.50 |
| ▸ | YWHAG | P61981 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7055286 | 0.79 | PDE4A (0.73) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL29324066 | 0.79 | PDE4A (0.47) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL31103624 | 0.79 | PDE4A (0.47) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL29324385 | 0.75 | PDE4A (0.50) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL29324375 | 0.73 | PDE4A (0.47) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL7058531 | 0.69 | ALDH1A1 (0.66) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL31103663 | 0.69 | PDE4A (0.44) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| SCHEMBL1072857 | 0.69 | RXFP1 (0.57) | RXFP1SMN1; SMN2 | |
| SCHEMBL7054220 | 0.69 | PDE4A (0.82) | ALDH1A1KDM4EPDE4APDE4BPDE4C | |
| Hydrochloric Acid SCHEMBL7055242 | 0.69 | ALDH1A1 (0.65) | ALDH1A1KDM4EPDE4APDE4BPDE4C |
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 |