Estrone Sulfuric Acid

Estrone Sulfuric Acid

SCHEMBL29950318

C[C@]12CC[C@@H]3c4ccc(OS(=O)(=O)[O-])cc4CC[C@H]3[C@@H]1CCC2=O.[Na+]

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

The experimentally established mechanism targets of Estrone Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 2/20 0.80
KDM4E B2RXH2 3/20 0.96
STS P08842 11/20 0.80
CA1 P00915 3/20 0.80
CA2 P00918 3/20 0.80
CA9 Q16790 3/20 0.80
ESR2 Q92731 2/20 0.80
ABCC4 O15439 1/20 0.80
CYP2C9 P11712 1/20 0.80
ABCC1 P33527 1/20 0.80
SLCO1B1 Q9Y6L6 1/20 0.80
CA4 P22748 1/20 0.80
CA6 P23280 1/20 0.80
LMNA P02545 2/20 0.76
MAPT P10636 2/20 0.76
HSD17B1 P14061 2/20 0.76
RECQL P46063 1/20 0.76
SMN1; SMN2 Q16637 1/20 0.76
CYP3A4 P08684 3/20 0.73
AKR1B10 O60218 1/20 0.67

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.

Compoundsimilaritytop predictedshared targets
Estrone Sulfuric Acid SCHEMBL4616 1.00 KDM4E (0.96) KDM4ESTSCA1CA2CA9
Estrone Sulfuric Acid SCHEMBL2296097 1.00 KDM4E (0.96) KDM4ESTSCA1CA2CA9
Estrone Sulfuric Acid SCHEMBL4812138 1.00 KDM4E (0.96) KDM4ESTSCA1CA2CA9
Estrone Sulfuric Acid SCHEMBL8901903 0.98 KDM4E (1.00) KDM4ESTSCA1CA2CA9
Estrone Sulfuric Acid SCHEMBL939946 0.98 KDM4E (1.00) KDM4ESTSCA1CA2CA9
Estrone Sulfuric Acid SCHEMBL28077672 0.98 KDM4E (1.00) KDM4ESTSCA1CA2CA9
SCHEMBL21067318 0.91 STS (0.84) KDM4ESTSCA1CA2CA9
Estrone Sulfuric Acid SCHEMBL29379988 0.90 STS (0.98) KDM4ESTSCA1CA2CA9
SCHEMBL8034430 0.90 STS (0.82) KDM4ESTSCA1CA2CA9
SCHEMBL17531381 0.90 STS (0.82) KDM4ESTSCA1CA2CA9

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119365466-A Tricyclic pyridones and pyrimidinones 医睿世康药业研发公司 2025-01-24 CN disclosed
CN-221510680-U Box is raised to armyworm 中国农业科学院草原研究所 2024-08-13 CN disclosed
US-12029932-B2 Mixture of non-polymer organic components with fire retardancy, preparation method and use PRIMALCHIT SOLUTIONS, S.L. (ES) 2024-07-09 US disclosed
CN-117866225-A Metal organic gel for detecting estrone and application thereof 哈深迪(广东)生物科技有限公司 2024-04-12 CN disclosed
US-20230414512-A1 Dermal Delivery Compositions Comprising Active Agent-Calcium Phosphate Particle Complexes and Methods of Using the Same LABORATORY SKIN CARE, INC. 2023-12-28 US disclosed
US-20230285565-A1 POLYTETRAFLUOROETHYLENE CO-POLYMER EMULSIONS W. L. GORE & ASSOCIATES, INC. 2023-09-14 US disclosed
CN-116656771-A Detection method for judging whether test object is SLC transporter substrate or inhibitor 江苏鼎泰药物研究(集团)股份有限公司 2023-08-29 CN disclosed
EP-4218718-A2 DERMAL DELIVERY COMPOSITIONS COMPRISING ACTIVE AGENT-CALCIUM PHOSPHATE PARTICLE COMPLEXES AND METHODS OF USING THE SAME Laboratory Skin Care, Inc. (US) 2023-08-02 EP disclosed
US-11642412-B2 Polytetrafluoroethylene co-polymer emulsions W. L. GORE & ASSOCIATES, INC. (US) 2023-05-09 US disclosed
US-20230045206-A1 Mixture of Non-Polymer Organic Components with Fire Retardancy, Preparation Method and Use PRIMALCHIT SOLUTIONS, S.L. (ES) 2023-02-09 US disclosed
EP-2427178-B1 DERMAL DELIVERY COMPOSITIONS COMPRISING ACTIVE AGENT-CALCIUM PHOSPHATE PARTICLE COMPLEXES AND METHODS OF USING THE SAME LABORATORY SKIN CARE INC (US) 2023-01-04 EP disclosed
US-20220401626-A1 LIQUID COMPOSITION AND POROUS HARDENED MATERIAL COMPRISING TETRAFLUOROETHYLENE AND VINYL MOIETY CO-POLYMERS W. L. GORE & ASSOCIATES, INC. 2022-12-22 US disclosed
US-20220362330-A1 Compositions and Methods for Increasing Epithelial Barrier Function THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2022-11-17 US disclosed
EP-4085976-A1 MIXTURE OF NON-POLYMER ORGANIC COMPONENTS WITH FIRE RETARDANCY, PREPARATION METHOD AND USE Primalchit Solutions, S.L. (ES) 2022-11-09 EP disclosed
EP-4058073-A1 LIQUID COMPOSITION AND POROUS HARDENED MATERIAL COMPRISING TETRAFLUOROETHYLENE AND VINYL MOIETY CO-POLYMERS W.L. Gore & Associates, Inc. (US) 2022-09-21 EP disclosed