Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9746606 | 0.84 | OPRM1 (0.40) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL8775770 | 0.80 | AKR1C3 (0.56) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL1688726 | 0.76 | ESR1 (0.59) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL9746981 | 0.72 | AKR1C3 (0.54) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL9747178 | 0.71 | ESR1 (0.76) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL15295782 | 0.70 | CYP3A4 (0.61) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL7548184 | 0.68 | ESR1 (0.44) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL8775793 | 0.68 | AKR1C3 (0.49) | ESR1SMN1; SMN2LMNAADORA3ATM | |
| SCHEMBL7548147 | 0.67 | PPARD (0.37) | ESR1SMN1; SMN2LMNAOPRM1MAPT | |
| SCHEMBL7547080 | 0.67 | PPARD (0.37) | ESR1SMN1; SMN2LMNAOPRM1MAPT |
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 |