Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 5/20 | 0.66 |
| ▸ | LMNA | P02545 | 5/20 | 0.66 |
| ▸ | AR | P10275 | 4/20 | 0.66 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.66 |
| ▸ | ESR1 | P03372 | 3/20 | 0.66 |
| ▸ | SHBG | P04278 | 3/20 | 0.66 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.59 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.52 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9619027 | 1.00 | PGR (0.66) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL9619042 | 0.92 | PGR (0.66) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL9618945 | 0.92 | PGR (0.66) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL10477562 | 0.90 | PGR (0.66) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL10618387 | 0.90 | PGR (0.66) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL13013727 | 0.89 | PGR (0.64) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL13770351 | 0.89 | PGR (0.64) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL985883 | 0.88 | PGR (0.63) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL11861113 | 0.88 | PGR (0.68) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL11797915 | 0.86 | PGR (0.68) | PGRLMNAARSLC6A4CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0137434-B1 | ESTRANE AND ANDROSTANE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-01-29 | — | — | EP | disclosed |
| US-4945064-A | Estrane and androstane derivatives, process for producing them and preparations containing these compounds | SCHERING AKTIENGESELLSCHAFT (DE) | 1990-07-31 | — | — | US | disclosed |
| US-4885117-A | Process for the preparation of (Z)-17α-halovinyl steroids | SCHERING AKTIENGESELLSCHAFT (DE) | 1989-12-05 | — | — | US | disclosed |