Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 9/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.41 |
| ▸ | AR | P10275 | 6/20 | 0.41 |
| ▸ | ESR1 | P03372 | 6/20 | 0.41 |
| ▸ | SHBG | P04278 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 4/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816492 | 1.00 | PGR (0.41) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL16389404 | 1.00 | PGR (0.41) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL17634423 | 1.00 | PGR (0.41) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL15059190 | 0.93 | PGR (0.38) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL16387350 | 0.88 | PGR (0.41) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL17634364 | 0.88 | PGR (0.41) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL15079255 | 0.81 | SRD5A2 (0.37) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL17591517 | 0.81 | SRD5A2 (0.37) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL15079265 | 0.81 | SRD5A2 (0.37) | PGRSLC6A4ARESR1SHBG | |
| SCHEMBL16389288 | 0.81 | SRD5A2 (0.37) | PGRSLC6A4ARESR1SHBG |
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 |
|---|---|---|---|---|---|---|---|
| EP-2794632-B1 | PROCESS FOR ALKYNYLATING 16-SUBSTITUTED-17-KETO STEROIDS | CRYSTAL PHARMA SAU (ES) | 2016-03-16 | — | — | EP | disclosed |