Estrone Sulfuric Acid

Estrone Sulfuric Acid

SCHEMBL23834600

C1CNCCN1.CCO.C[C@]12CC[C@@H]3c4ccc(OS(=O)(=O)O)cc4CC[C@H]3[C@@H]1CCC2=O

nearest known ligand 0.93

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 0.68
CYP3A4 P08684 4/20 0.93
STS P08842 8/20 0.84
ABCC4 O15439 3/20 0.84
ABCC1 P33527 2/20 0.84
CYP2C9 P11712 1/20 0.84
SLCO1B1 Q9Y6L6 1/20 0.84
KDM4E B2RXH2 2/20 0.68
ESR2 Q92731 2/20 0.68
CA1 P00915 2/20 0.68
CA2 P00918 2/20 0.68
CA9 Q16790 2/20 0.68
CA4 P22748 1/20 0.68
CA6 P23280 1/20 0.68
MAPT P10636 3/20 0.64
LMNA P02545 2/20 0.64
HSD17B1 P14061 2/20 0.64
RECQL P46063 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
ALDH1A1 P00352 1/20 0.62

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 SCHEMBL17395922 0.96 CYP3A4 (0.93) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL21577 0.96 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL4443808 0.96 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL7216979 0.96 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL6556684 0.96 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL29366794 0.96 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL481201 0.96 CYP3A4 (1.00) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL6931138 0.95 CYP3A4 (0.98) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL19100296 0.95 CYP3A4 (0.98) CYP3A4STSABCC4ABCC1CYP2C9
Estrone Sulfuric Acid SCHEMBL14844580 0.95 CYP3A4 (0.98) CYP3A4STSABCC4ABCC1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4392564-A1 MICROBIAL FERMENTATION FOR THE PRODUCTION OF ISOPRENOID ALCOHOLS AND DERIVATIVES Lanzatech, Inc. (US) 2024-07-03 EP disclosed
EP-4381076-A1 MICROORGANISMS AND METHODS FOR IMPROVED BIOLOGICAL PRODUCTION OF ETHYLENE GLYCOL Lanzatech, Inc. (US) 2024-06-12 EP disclosed
WO-2024020364-A1 METHOD AND SYSTEM FOR MONITORING AND CONTROLLING CONTINUOUS GAS FERMENTATION WITH BIOMARKERS LANZATECH, INC. (US) 2024-01-25 WO disclosed
EP-4305173-A1 RECOMBINANT MICROORGANISMS AND USES THEREFOR Lanzatech, Inc. (US) 2024-01-17 EP disclosed
WO-2023250389-A1 MICROORGANISMS AND METHODS FOR THE CONTINUOUS CO-PRODUCTION OF HIGH-VALUE, SPECIALIZED PROTEINS AND CHEMICAL PRODUCTS FROM C1-SUBSTRATES LANZATECH, INC. (US) 2023-12-28 WO disclosed
EP-4217501-A1 RECOMBINANT MICROORGANISMS AND USES THEREFOR Lanzatech, Inc. (US) 2023-08-02 EP disclosed
EP-4208554-A1 RECOMBINANT MICROORGANISMS AND USES THEREFOR Lanzatech, Inc. (US) 2023-07-12 EP disclosed
EP-4162056-A1 MICROORGANISM WITH KNOCK-IN AT ACETOLACTATE DECARBOXYLASE GENE LOCUS Lanzatech, Inc. (US) 2023-04-12 EP disclosed
EP-4143325-A1 FERMENTATIVE PRODUCTION OF BETA-KETOADIPATE FROM GASEOUS SUBSTRATES Lanzatech, Inc. (US) 2023-03-08 EP disclosed
WO-2023028459-A1 MICROBIAL FERMENTATION FOR THE PRODUCTION OF ISOPRENOID ALCOHOLS AND DERIVATIVES LANZATECH, INC. (US) 2023-03-02 WO disclosed
WO-2022192865-A9 RECOMBINANT MICROORGANISMS AND USES THEREFOR LANZATECH, INC. (US) 2023-02-09 WO disclosed
WO-2023015285-A1 MICROORGANISMS AND METHODS FOR IMPROVED BIOLOGICAL PRODUCTION OF ETHYLENE GLYCOL LANZATECH, INC. (US) 2023-02-09 WO disclosed
WO-2022170191-A9 RECOMBINANT MICROORGANISMS AND USES THEREFOR LANZATECH, INC. (US) 2023-02-02 WO disclosed
WO-2023004293-A1 RECOMBINANT MICROORGANISMS AND USES THEREFOR LANZATECH, INC. (US) 2023-01-26 WO disclosed
WO-2023004295-A1 RECOMBINANT MICROORGANISMS AS A VERSATILE AND STABLE PLATFORM FOR PRODUCTION OF ANTIGEN-BINDING MOLECULES LANZATECH, INC. (US) 2023-01-26 WO disclosed
EP-4121542-A1 FERMENTATIVE PRODUCTION OF 2-PHENYLETHANOL FROM GASEOUS SUBSTRATES Lanzatech, Inc. (US) 2023-01-25 EP disclosed
WO-2021222265-A1 FERMENTATIVE PRODUCTION OF β-KETOADIPATE FROM GASEOUS SUBSTRATES LANZATECH, INC. (US) 2021-11-04 WO disclosed
WO-2021188190-A1 FERMENTATIVE PRODUCTION OF 2-PHENYLETHANOL FROM GASEOUS SUBSTRATES LANZATECH, INC. (US) 2021-09-23 WO disclosed