Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.54 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | CNR1 | P21554 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ESR1 | P03372 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | RORA | P35398 | 1/20 | 0.47 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5622498 | 0.87 | KEAP1 (0.68) | KEAP1NFE2L2CNR2LMNACNR1 | |
| SCHEMBL8656600 | 0.84 | HCRTR2 (0.52) | LMNAMAPTESR1ALDH1A1NPSR1 | |
| SCHEMBL7182031 | 0.81 | ESR1 (0.79) | KEAP1NFE2L2CNR2LMNACNR1 | |
| SCHEMBL8657231 | 0.81 | RORC (0.53) | MAPTESR1TSHRNPSR1NR3C1 | |
| SCHEMBL28728523 | 0.80 | CNR1 (0.70) | KEAP1NFE2L2CNR2LMNACNR1 | |
| SCHEMBL1039041 | 0.76 | HCRTR2 (0.77) | KEAP1NFE2L2MAPTALDH1A1TP53 | |
| SCHEMBL5622632 | 0.76 | KEAP1 (0.64) | KEAP1NFE2L2CNR2LMNACNR1 | |
| SCHEMBL1630208 | 0.73 | KEAP1 (0.81) | KEAP1NFE2L2MAPT | |
| SCHEMBL5622935 | 0.73 | KEAP1 (0.61) | KEAP1NFE2L2CNR2LMNACNR1 | |
| SCHEMBL5624485 | 0.73 | KEAP1 (0.61) | KEAP1NFE2L2CNR2LMNACNR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5780642-A | NON-STEROIDAL ANTIINFLAMMATORY AGENT WHICH BLOCKS RELEASE OF ARACHIDONIC ACID FROM PHOSPHOLIPIDS; SIDE EFFECT REDUCTION | KNOLL AKTIENGESELLSCHAFT (DE) | 1998-07-14 | — | — | US | disclosed |