Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 3/20 | 0.49 |
| ▸ | ESR1 | P03372 | 4/20 | 0.48 |
| ▸ | AR | P10275 | 4/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 7/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GUSB | P08236 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24358655 | 0.86 | SHBG (0.53) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL11731128 | 0.86 | SHBG (0.53) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL9195965 | 0.86 | SHBG (0.53) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL24358654 | 0.86 | SHBG (0.53) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL11643796 | 0.84 | ESR1 (0.41) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL9541141 | 0.83 | CYP17A1 (0.47) | SHBGESR1ARESR2ALDH1A1 | |
| SCHEMBL11326365 | 0.82 | CYP19A1 (0.57) | SHBGSRD5A2LMNAGUSB | |
| SCHEMBL24358694 | 0.78 | SRD5A2 (0.59) | SHBGESR1ARESR2CYP2C19 | |
| Penmesterol SCHEMBL547668 | 0.77 | SHBG (0.48) | SHBGESR1ARESR2CYP2C19 | |
| SCHEMBL28118289 | 0.76 | SHBG (0.49) | SHBGESR1ARESR2CYP2C19 |
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-1993013122-A1 | 3-METHYLSULPHONYLHYDRAZONO AND 3-OXYIMINO STEROIDS, A METHOD OF PREPARING THEM, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR USE IN THE PREPARATION OF DRUGS | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-07-08 | — | — | WO | disclosed |