Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 7/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.73 |
| ▸ | AR | P10275 | 6/20 | 0.73 |
| ▸ | PGR | P06401 | 6/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.73 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.73 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.73 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.73 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.73 |
| ▸ | USP2 | O75604 | 2/20 | 0.73 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.73 |
| ▸ | THRB | P10828 | 1/20 | 0.73 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.73 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.73 |
| ▸ | LMNA | P02545 | 5/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL1406037 | 1.00 | NR3C1 (0.73) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| SCHEMBL1405853 | 1.00 | NR3C1 (0.73) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| SCHEMBL1405851 | 1.00 | NR3C1 (0.73) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| SCHEMBL13595777 | 0.89 | NR3C1 (0.73) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| SCHEMBL20843739 | 0.88 | AR (0.72) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| Clogestone Acetate SCHEMBL29857472 | 0.87 | NR3C1 (0.70) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| Clogestone Acetate SCHEMBL282096 | 0.87 | NR3C1 (0.70) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| SCHEMBL11647028 | 0.85 | NR3C1 (0.55) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| SCHEMBL11647023 | 0.85 | NR3C1 (0.55) | NR3C1CYP3A4ARPGRSMN1; SMN2 | |
| Chlormadinone Acetate SCHEMBL4948575 | 0.84 | AR (1.00) | NR3C1CYP3A4ARPGRSMN1; SMN2 |
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-2009141110-A1 | METHOD FOR THE SELECTIVE SYNTHESIS OF 3-ALPHA-HYDROXY-CHLORMADINONE ACETATE | Grünenthal GmbH (DE) | 2009-11-26 | — | — | WO | disclosed |