Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.34 |
| ▸ | SHBG | P04278 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | PGR | P06401 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | HRH2 | P25021 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9542435 | 0.91 | CYP17A1 (0.46) | CYP17A1CYP19A1CYP3A4LMNANR3C1 | |
| SCHEMBL9542606 | 0.84 | SHBG (0.46) | CYP19A1CYP3A4LMNANR3C1SHBG | |
| SCHEMBL9542059 | 0.81 | CYP19A1 (0.60) | CYP17A1CYP19A1CYP3A4SHBGHIF1A | |
| SCHEMBL9542062 | 0.81 | CYP19A1 (0.60) | CYP17A1CYP19A1CYP3A4SHBGHIF1A | |
| SCHEMBL9541909 | 0.79 | CYP17A1 (0.46) | CYP17A1CYP19A1CYP3A4LMNANR3C1 | |
| SCHEMBL9541266 | 0.77 | CYP17A1 (0.51) | CYP17A1CYP19A1CYP3A4LMNANR3C1 | |
| SCHEMBL9541894 | 0.75 | SHBG (0.46) | CYP19A1CYP3A4LMNANR3C1SHBG | |
| SCHEMBL9544750 | 0.74 | SHBG (0.45) | CYP19A1CYP3A4LMNANR3C1SHBG | |
| SCHEMBL9542647 | 0.74 | SHBG (0.45) | CYP19A1CYP3A4LMNANR3C1SHBG | |
| SCHEMBL9544756 | 0.74 | SHBG (0.45) | CYP19A1CYP3A4LMNANR3C1SHBG |
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 |
|---|---|---|---|---|---|---|---|
| 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 | claimed |
| 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 |