Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11762473 | 0.82 | NFE2L2 (0.48) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL16085849 | 0.82 | NFE2L2 (0.48) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL2302497 | 0.80 | NFE2L2 (0.46) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL1051328 | 0.80 | NFE2L2 (0.46) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL6963714 | 0.80 | NFE2L2 (0.46) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL8325367 | 0.79 | TAAR1 (0.48) | TAAR1CYP1A2ALOX5PTGS1PTGS2 | |
| SCHEMBL21411331 | 0.78 | NFE2L2 (0.45) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL21411330 | 0.78 | NFE2L2 (0.45) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL5808056 | 0.78 | CA1 (0.47) | NFE2L2RELACA1GRIK1GRIK2 | |
| SCHEMBL8325205 | 0.78 | AHR (0.45) | NFE2L2GRIK1GRIK2TAAR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004071445-A2 | 2-(AMINOMETHYL)ARYLAMIDE ANALGESICS | PHARMACOPEIA DRUG DISCOVERY, INC. (US) | 2004-08-26 | — | — | WO | disclosed |