Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.63 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | DRD2 | P14416 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | CCR3 | P51677 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL486687 | 1.00 | SLC6A3 (0.66) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| Hydrochloric Acid SCHEMBL486705 | 0.98 | SLC6A3 (0.63) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| Iodide SCHEMBL195620 | 0.98 | SLC6A3 (0.63) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| Hydrochloric Acid SCHEMBL7810971 | 0.92 | SLC6A3 (0.66) | SLC6A3SIGMAR1HTR1ADRD2NPC1 | |
| SCHEMBL3959376 | 0.89 | SIGMAR1 (0.72) | SIGMAR1CCR3 | |
| SCHEMBL21047654 | 0.89 | SLC6A3 (0.56) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| SCHEMBL6705256 | 0.87 | SIGMAR1 (0.67) | SIGMAR1CCR3MEN1KMT2A | |
| SCHEMBL5612374 | 0.86 | SIGMAR1 (0.70) | SIGMAR1CCR3MEN1KMT2A | |
| SCHEMBL14407778 | 0.83 | SLC6A3 (0.83) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| SCHEMBL6056974 | 0.83 | SLC6A3 (0.83) | SLC6A3SIGMAR1HTR1ADRD2ACHE |
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-1056744-A1 | 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES | Aventis Pharmaceuticals Inc. (US) | 2000-12-06 | — | — | EP | disclosed |
| WO-1999043675-A1 | 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES | AVENTIS PHARMACEUTICALS INC. (US) | 1999-09-02 | — | — | WO | disclosed |