Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 10/20 | 0.61 |
| ▸ | PGR | P06401 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.55 |
| ▸ | AR | P10275 | 3/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11594860 | 1.00 | CYP19A1 (0.61) | CYP19A1PGRTDP1NR3C1LMNA | |
| SCHEMBL10959975 | 0.87 | PGR (0.65) | CYP19A1PGRTDP1NR3C1LMNA | |
| SCHEMBL10959989 | 0.87 | PGR (0.65) | CYP19A1PGRTDP1NR3C1LMNA | |
| Canrenoate SCHEMBL636758 | 0.81 | PGR (0.81) | CYP19A1PGRTDP1NR3C1LMNA | |
| Canrenoate SCHEMBL18775372 | 0.81 | PGR (0.81) | CYP19A1PGRTDP1NR3C1LMNA | |
| Canrenoate SCHEMBL3510075 | 0.81 | PGR (0.81) | CYP19A1PGRTDP1NR3C1LMNA | |
| Canrenoate SCHEMBL11341384 | 0.81 | PGR (0.81) | CYP19A1PGRTDP1NR3C1LMNA | |
| SCHEMBL10960591 | 0.78 | PGR (0.64) | CYP19A1PGRTDP1NR3C1LMNA | |
| SCHEMBL10960596 | 0.78 | PGR (0.64) | CYP19A1PGRTDP1NR3C1LMNA | |
| Potassium Ion SCHEMBL10959982 | 0.78 | TDP1 (0.71) | CYP19A1PGRTDP1NR3C1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4069219-A | 7ξ-(Alkoxycarbonyl)-6ξ-alkyl/halo-17-hydroxy-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactones and corresponding 21-carboxylic acids, their salts, and esters | G. D. SEARLE & CO. (US) | 1978-01-17 | — | — | US | disclosed |