Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL2995590 | 0.78 | CHRNA7 (0.34) | NPC1RAB9AALDH1A1SLC6A4SLC6A3 | |
| SCHEMBL31146882 | 0.74 | DAO (0.35) | NPC1RAB9ASLC6A4SLC6A3KMT2A | |
| SCHEMBL1742802 | 0.69 | CYP3A4 (0.44) | NPC1RAB9AALDH1A1GAASLC6A4 | |
| SCHEMBL31709528 | 0.69 | CYP3A4 (0.44) | NPC1RAB9AALDH1A1GAASLC6A4 | |
| SCHEMBL31146887 | 0.68 | TAAR1 (0.32) | SLC6A4SLC6A3 | |
| SCHEMBL31146867 | 0.68 | CYP3A4 (0.38) | ALDH1A1SLC6A4HPGDSMN1; SMN2 | |
| SCHEMBL31146876 | 0.66 | GABRA1 (0.33) | NPC1RAB9AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL31146884 | 0.64 | KDM4E (0.38) | NPC1RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL4146714 | 0.64 | CYP3A4 (0.37) | NPC1RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL4129144 | 0.63 | SMN1; SMN2 (0.37) | NPC1RAB9AALDH1A1HPGDSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4680606-A1 | ADENINE DERIVATIVES AS HSP90 INHIBITORS | AtmosR (FR) | 2026-01-21 | — | — | EP | disclosed |
| WO-2024194175-A1 | ADENINE DERIVATIVES AS HSP90 INHIBITORS | ATMOSR (FR) | 2024-09-26 | — | — | WO | disclosed |