Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR1B | P28222 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR1E | P28566 | 1/20 | 0.30 |
| ▸ | HTR1F | P30939 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | HTR3A | P46098 | 1/20 | 0.30 |
| ▸ | HTR5A | P47898 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
| ▸ | HTR4 | Q13639 | 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 | 0.76 | CHRNA7 (0.34) | TAAR1SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL31146867 | 0.75 | CYP3A4 (0.38) | SLC6A2SLC6A4HTR3EHTR3BHTR1A | |
| SCHEMBL31146882 | 0.75 | DAO (0.35) | SLC6A4SLC6A3HTR3EHTR3BHTR1A | |
| SCHEMBL31146876 | 0.73 | GABRA1 (0.33) | — | |
| SCHEMBL31146889 | 0.68 | NPC1 (0.40) | SLC6A4SLC6A3 | |
| SCHEMBL1742802 | 0.66 | CYP3A4 (0.44) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL31709528 | 0.66 | CYP3A4 (0.44) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL21035429 | 0.65 | CYP3A4 (0.37) | TAAR1SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL4130159 | 0.63 | MAPT (0.40) | CYP2D6 | |
| SCHEMBL1743402 | 0.62 | CYP3A4 (0.37) | CYP2D6 |
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 |