Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 3/20 | 0.66 |
| ▸ | NQO2 | P16083 | 2/20 | 0.66 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.59 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.59 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.55 |
| ▸ | F3 | P13726 | 1/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.54 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | AHR | P35869 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | ABL1 | P00519 | 1/20 | 0.53 |
| ▸ | TTR | P02766 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | BCR | P11274 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL23250710 | 0.88 | HDAC4 (0.56) | RELANQO2KDM4ETHRBALDH1A1 | |
| SCHEMBL631998 | 0.79 | RELA (0.81) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL699457 | 0.79 | RELA (0.81) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL13790336 | 0.79 | RELA (0.81) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL4881152 | 0.79 | RELA (0.81) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL699458 | 0.79 | RELA (0.81) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL14950253 | 0.79 | RELA (0.81) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL5495966 | 0.79 | NQO2 (1.00) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL5495964 | 0.79 | NQO2 (1.00) | RELANQO2NFE2L2PTGS2KDM4E | |
| SCHEMBL30940357 | 0.79 | NQO2 (1.00) | RELANQO2NFE2L2PTGS2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-109562050-B | Gel-like composition | 株式会社钟化 | 2022-05-10 | — | — | CN | disclosed |