Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 6/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 5/20 | 0.47 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.44 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4789479 | 0.91 | LCK (0.46) | KCNH2SCN9ASCN5ASRPK1GPR52 | |
| SCHEMBL4789251 | 0.89 | KCNH2 (0.45) | KCNH2SCN9ASCN5ASRPK1GPR52 | |
| SCHEMBL6820334 | 0.87 | KCNH2 (0.55) | KCNH2SCN9ASCN5ASRPK1MTNR1A | |
| SCHEMBL6820338 | 0.87 | KCNH2 (0.55) | KCNH2SCN9ASCN5ASRPK1MTNR1A | |
| SCHEMBL7025761 | 0.87 | KCNH2 (0.55) | KCNH2SCN9ASCN5ASRPK1MTNR1A | |
| SCHEMBL7031232 | 0.86 | MEN1 (0.55) | KCNH2SCN9ASCN5AGPR52CHRM4 | |
| SCHEMBL7030282 | 0.86 | MEN1 (0.55) | KCNH2SCN9ASCN5AGPR52CHRM4 | |
| SCHEMBL4788895 | 0.85 | KCNH2 (0.49) | KCNH2SCN9ASCN5ASRPK1GPR52 | |
| SCHEMBL7029805 | 0.80 | KCNH2 (0.54) | KCNH2SCN9ASCN5AMTNR1AMTNR1B | |
| SCHEMBL7019156 | 0.80 | KCNH2 (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 |