Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 12/20 | 0.64 |
| ▸ | PGR | P06401 | 6/20 | 0.64 |
| ▸ | AR | P10275 | 6/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.62 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.62 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | CNR1 | P21554 | 1/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7086668 | 1.00 | NR3C1 (0.64) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL7132531 | 0.99 | NR3C1 (0.65) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL7085660 | 0.93 | PGR (0.65) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL7136444 | 0.93 | NR3C1 (0.62) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL7085292 | 0.92 | NR3C1 (0.62) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL1379945 | 0.91 | NR3C1 (0.61) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL15203811 | 0.91 | NR3C1 (0.61) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL4934154 | 0.91 | NR3C1 (0.64) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL14027145 | 0.91 | NR3C1 (0.64) | NR3C1PGRARCYP3A4HIF1A | |
| SCHEMBL4937640 | 0.91 | NR3C1 (0.64) | NR3C1PGRARCYP3A4HIF1A |
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-2003072592-A1 | 17.ALPHA-CYCLOALKYL/CYCLOYLKENYL ESTERS OF ALKYL-OR HALOALKYL-ANDROST-4-EN-3-ON-11.BETA.,17.ALPHA.-DIOL 17.BETA.-CARBOXYLATES AS ANTI-INFLAMMATORY AGENTS | GLAXO GROUP LIMITED (GB) | 2003-09-04 | — | — | WO | disclosed |