Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.36 |
| ▸ | CDK2 | P24941 | 3/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20525320 | 0.86 | POLB (0.36) | OPRK1KCNH2LMNA | |
| SCHEMBL20525417 | 0.85 | FGFR1 (0.32) | OPRK1KCNH2SIRT2SIRT1RPS6KB1 | |
| SCHEMBL20525423 | 0.85 | SCN9A (0.42) | ADRA1DSCN9AMKNK1MKNK2PARP1 | |
| SCHEMBL20525382 | 0.83 | CYP1A2 (0.38) | OPRM1ADRA1DSCN9AMKNK1MKNK2 | |
| SCHEMBL20525408 | 0.82 | FAAH (0.38) | OPRM1ADRA1DSCN9A | |
| SCHEMBL16804284 | 0.82 | HDAC1 (0.42) | SCN9A | |
| SCHEMBL18108914 | 0.81 | POLB (0.42) | OPRK1KCNH2OPRM1SCN9AACACB | |
| SCHEMBL16804431 | 0.81 | POLB (0.42) | OPRK1KCNH2OPRM1SCN9AACACB | |
| SCHEMBL20525349 | 0.79 | SCN9A (0.46) | KCNH2OPRM1ADRA1DSCN9AACACB | |
| SCHEMBL20525436 | 0.78 | FGFR1 (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3080125-B1 | NOVEL AZAINDOLE DERIVATIVES AS SELECTIVE HISTONE DEACETYLASE (HDAC) INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-10-10 | — | — | EP | disclosed |