Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 3/20 | 0.41 |
| ▸ | G6PD | P11413 | 3/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 4/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.38 |
| ▸ | AR | P10275 | 3/20 | 0.38 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GUSB | P08236 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3112585 | 0.84 | ESR1 (0.45) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL4152712 | 0.84 | ESR1 (0.45) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL3112594 | 0.84 | ESR1 (0.45) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL6899626 | 0.83 | SHBG (0.44) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL7259576 | 0.78 | SHBG (0.41) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL23155091 | 0.75 | SHBG (0.64) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL11970666 | 0.75 | SHBG (0.64) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL14149814 | 0.75 | SHBG (0.64) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL336035 | 0.75 | SHBG (0.64) | SHBGG6PDCYP17A1TBXAS1SRD5A2 | |
| SCHEMBL13461623 | 0.75 | SHBG (0.64) | SHBGG6PDCYP17A1TBXAS1SRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0291717-A1 | 17Beta-(cyclopropyloxy) androst-5-en-3beta-ol and related compounds useful as c 17-20 lyase inhibitors | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-11-23 | — | — | EP | claimed |
| EP-0413269-A2 | 4-substituted 17-beta-(cyclopropyloxy)androst-5-EN-3-beta-OL and related compounds useful as C17-20 lyase inhibitors | MERRELL PHARMACEUTICALS INC. (US) | 1991-02-20 | — | — | EP | disclosed |