Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 7/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 4/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3533482 | 0.82 | HSD11B1 (0.48) | NR3C1HSD11B1 | |
| SCHEMBL27650712 | 0.82 | PDK1 (0.43) | NR3C2HSD11B1CNR1CNR2 | |
| SCHEMBL27600117 | 0.76 | NR3C1 (0.40) | NR3C1NR3C2PGR | |
| SCHEMBL3537352 | 0.75 | NR3C1 (0.42) | NR3C1NR3C2HSD11B1PGR | |
| SCHEMBL5776235 | 0.75 | NR3C1 (0.42) | NR3C1NR3C2PGR | |
| SCHEMBL27793273 | 0.73 | CA1 (0.41) | HSD11B1AKR1C3AKR1C2RXRARXRB | |
| SCHEMBL4629304 | 0.73 | NR3C1 (0.64) | NR3C1NR3C2PGR | |
| SCHEMBL3533752 | 0.73 | NR3C2 (0.52) | NR3C1NR3C2PGR | |
| SCHEMBL3535507 | 0.73 | NR3C1 (0.43) | NR3C1NR3C2PGR | |
| SCHEMBL27600022 | 0.73 | NR3C1 (0.41) | NR3C1NR3C2PGR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1867555-A | Rearranged pentanols, process for their preparation and their use as anti-inflammatory agents | SCHERING AG (DE) | 2006-11-22 | — | — | CN | disclosed |
| CN-1816532-A | Heterocyclically-substituted pentanol derivatives, process for their production and their use as anti-inflammatory agents | SCHERING AG (DE) | 2006-08-09 | — | — | CN | disclosed |