Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | BACE1 | P56817 | 3/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11530957 | 1.00 | NFE2L2 (0.40) | NFE2L2RELACYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11527964 | 0.87 | NFE2L2 (0.44) | NFE2L2RELACYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11527960 | 0.87 | NFE2L2 (0.44) | NFE2L2RELACYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11306176 | 0.86 | LDHA (0.41) | — | |
| SCHEMBL11530709 | 0.78 | RELA (0.48) | NFE2L2RELACYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11530716 | 0.78 | RELA (0.48) | NFE2L2RELACYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11457464 | 0.75 | LDHA (0.48) | — | |
| SCHEMBL11527142 | 0.72 | HTR2A (0.34) | — | |
| SCHEMBL11525535 | 0.72 | RELA (0.53) | NFE2L2RELACYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11525531 | 0.72 | RELA (0.53) | NFE2L2RELACYP1A1CYP1B1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4153719-A | Aromatic diketones | STERLING DRUG INC. (US) | 1979-05-08 | — | — | US | claimed |
| US-4153719-A | Aromatic diketones | STERLING DRUG INC. (US) | 1979-05-08 | — | — | US | disclosed |