Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.46 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 4/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | F11 | P03951 | 1/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4849815 | 1.00 | KCNH2 (0.46) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7028633 | 0.88 | MTNR1A (0.53) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7028629 | 0.88 | MTNR1A (0.53) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL4863525 | 0.88 | KCNH2 (0.47) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL4863518 | 0.88 | KCNH2 (0.47) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7023472 | 0.86 | MTNR1A (0.55) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7030289 | 0.86 | MTNR1A (0.55) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7026344 | 0.83 | MTNR1A (0.52) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7026340 | 0.83 | MTNR1A (0.52) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7030412 | 0.83 | MTNR1A (0.54) | KCNH2SCN9ASCN5AMTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008130323-A1 | NOVEL 8-PIPERAZINE-TETRAHYDRONAPHTALENE DERIVATIVES FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2008-10-30 | — | — | WO | claimed |
| WO-2008130323-A1 | NOVEL 8-PIPERAZINE-TETRAHYDRONAPHTALENE DERIVATIVES FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2008-10-30 | — | — | WO | disclosed |