Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 5/20 | 0.69 |
| ▸ | PGR | P06401 | 5/20 | 0.69 |
| ▸ | AR | P10275 | 4/20 | 0.69 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.69 |
| ▸ | LMNA | P02545 | 5/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.55 |
| ▸ | HTR2B | P41595 | 2/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.55 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL14568580 | 1.00 | NR3C1 (0.69) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14565706 | 0.93 | PGR (0.66) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14284946 | 0.93 | PGR (0.66) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14285009 | 0.91 | NR3C1 (0.67) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14284952 | 0.91 | NR3C1 (0.67) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14084961 | 0.90 | NR3C1 (0.70) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14567812 | 0.90 | NR3C1 (0.70) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14450055 | 0.90 | NR3C1 (0.70) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14508986 | 0.90 | NR3C1 (0.70) | NR3C1PGRARNR3C2LMNA | |
| SCHEMBL14565704 | 0.90 | NR3C1 (0.70) | NR3C1PGRARNR3C2LMNA |
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-2013064620-A1 | 18-METHYL-6,7-METHYLENE-3-OXO-17-PREGN-4-ENE-21,17Β-CARBOLACTONES, PHARMACEUTICAL PREPARATIONS COMPRISING SAID COMPOUNDS AND USE THEREOF IN THE TREATMENT OF ENDOMETRIOSIS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2013-05-10 | — | — | WO | disclosed |