Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.76 |
| ▸ | LMNA | P02545 | 4/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.76 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.76 |
| ▸ | ATM | Q13315 | 2/20 | 0.76 |
| ▸ | PGR | P06401 | 1/20 | 0.76 |
| ▸ | AR | P10275 | 1/20 | 0.76 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.76 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.76 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.76 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.76 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.76 |
| ▸ | MAPT | P10636 | 4/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.74 |
| ▸ | TP53 | P04637 | 2/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.65 |
| ▸ | THRB | P10828 | 1/20 | 0.65 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.59 |
| ▸ | SHBG | P04278 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Estradiol Acetate SCHEMBL2099105 | 0.87 | ESR1 (1.00) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| Estradiol Acetate SCHEMBL29575955 | 0.87 | ESR1 (1.00) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| Estradiol Acetate SCHEMBL20874461 | 0.87 | ESR1 (1.00) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| Estradiol Acetate SCHEMBL148561 | 0.87 | ESR1 (1.00) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| Estradiol Acetate SCHEMBL10201260 | 0.87 | ESR1 (1.00) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| Estradiol Acetate SCHEMBL13712636 | 0.87 | ESR1 (1.00) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| SCHEMBL7054352 | 0.86 | LMNA (0.72) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| SCHEMBL15308955 | 0.86 | LMNA (0.72) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| SCHEMBL4995702 | 0.86 | LMNA (0.72) | ESR1LMNASMN1; SMN2ADORA3ATM | |
| SCHEMBL7054356 | 0.86 | LMNA (0.72) | ESR1LMNASMN1; SMN2ADORA3ATM |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE34136-E | Morning-after contraceptives | SRI INTERNATIONAL (US) | 1992-12-01 | — | — | US | disclosed |
| US-4859370-A | 9 alpha, 11 beta-substituted and 11 beta-substituted estranes | SRI INTERNATIONAL (US) | 1989-08-22 | — | — | US | disclosed |
| US-4705783-A | 9α, 11β-substituted and 11β-substituted estranes | SRI INTERNATIONAL (US) | 1987-11-10 | — | — | US | disclosed |
| WO-1987000175-A1 | 9alpha, 11beta-SUBSTITUTED AND 11beta-SUBSTITUTED ESTRANES | SRI INTERNATIONAL (US) | 1987-01-15 | — | — | WO | disclosed |