Digitoxin

Digitoxin

SCHEMBL20940

C[C@H]1O[C@@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ATP1A1ATP1A2ATP1A3ATP1A4ATP1B1ATP1B2ATP1B3FXYD2

The experimentally established mechanism targets of Digitoxin. 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
ATP1A1 known ✓ P05023 10/20 1.00
ATP1B1 known ✓ P05026 10/20 1.00
ATP1A3 known ✓ P13637 10/20 1.00
ATP1B2 known ✓ P14415 10/20 1.00
ATP1A2 known ✓ P50993 10/20 1.00
ATP1B3 known ✓ P54709 10/20 1.00
FXYD2 known ✓ P54710 10/20 1.00
ATP1A4 known ✓ Q13733 10/20 1.00
TP53 P04637 5/20 1.00
SMN1; SMN2 Q16637 5/20 1.00
LMNA P02545 5/20 1.00
NPC1 O15118 2/20 1.00
STAT3 P40763 2/20 1.00
RAB9A P51151 2/20 1.00
USP2 O75604 1/20 1.00
ABCB11 O95342 1/20 1.00
MAPT P10636 1/20 1.00
SLCO4C1 Q6ZQN7 1/20 1.00
PAX8 Q06710 2/20 0.81
HIF1A Q16665 2/20 0.81

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
Digitoxin SCHEMBL17864034 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL18949488 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL18947798 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL2321116 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL12038722 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL16442430 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL17862021 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL20582729 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL20970016 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Digitoxin SCHEMBL18542099 1.00 ATP1A1 (1.00) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2

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

Appears in 17981 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026102542-A1 ATPASE INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NON-NEUROLOGICAL DISORDERS HAPLO THERAPEUTICS INC. (CA) 2026-05-21 WO claimed
CN-122055374-A Lipid compounds and compositions for tissue-specific delivery of active substances 韩国生命工学研究院 2026-05-15 CN claimed
CN-122024819-A Method for screening atopic dermatitis key autophagy genes based on transcriptome and machine learning 常德市第一人民医院 2026-05-12 CN claimed
WO-2026087680-A1 TREATMENT FOR CARDIOVASCULAR DISEASE SAPREME TECHNOLOGIES B.V. (NL) 2026-04-30 WO claimed
WO-2026087695-A1 TREATMENT FOR METABOLIC DISORDER SAPREME TECHNOLOGIES B.V. (NL) 2026-04-30 WO claimed
EP-3730131-B1 TREATMENT OF BRAIN CANCER BY CONTINUOUS INFUSION OF COENZYME Q10 BPGBIO INC (US) 2026-04-22 EP claimed
EP-4724049-A1 MODIFIED RELEASE FILL COMPOSITIONS FOR DOSAGE FORMS AND METHODS OF PREPARATION AND USE THEREOF Catalent Ontario Limited (CA) 2026-04-15 EP claimed
EP-4637824-A1 METHOD OF PREVENTING AND TREATING ALZHEIMER'S DISEASE AND RELATED DEMENTIAS WITH DRUGS INHIBITING THE INTERACTION BETWEEN 14-3-3G PROTEIN AND HEXOKINASE-1 PROTEIN BIOVENTURES, LLC (US) 2025-10-29 EP claimed
WO-2025217305-A1 DEVICES, KITS, AND METHODS FOR DELIVERING MEDICATION VIA THE LUNGS INCARDA THERAPEUTICS, INC. (US) 2025-10-16 WO claimed
US-20250295693-A1 HYBRID TUMOR/CANCER THERAPY BASED ON TARGETING THE RESOLUTION OF OR INDUCING TRANSCRIPTION-REPLICATION CONFLICTS (TRCS) JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2025-09-25 US claimed
US-4182330-A Means for administering amphipathic medicament ALZA CORPORATION (US) 1980-01-08 US claimed
US-4133949-A Dicarboxylic acid esters of cardiac glycosides BOEHRINGER MANNHEIM GMBH (DE) 1979-01-09 US claimed
US-4115539-A RADIOIMMUNOASSAY, REACTION PRODUCT WITH ISOCYANATES UNION CARBIDE CORPORATION (US) 1978-09-19 US claimed
US-4067960-A GELATIN CAPSULE, CARDIOTONIC R. P. SCHERER LIMITED (EN) 1978-01-10 US claimed
US-4064227-A Radioimmunoassay method for the determination of cardiotonic glycosides MALLINCKRODT, INC. (US) 1977-12-20 US claimed
US-4056608-A IMMUNOASSAY SYVA COMPANY (US) 1977-11-01 US claimed
US-4039652-A ANTIGENS, ANTIBODIES MILES LABORATORIES, INC. (US) 1977-08-02 US claimed
US-3995019-A FOR RADIOIMMUNOASSAY CONSISTING OF A SPECIFIC ANTIBODY RADIOLABELED, ANTIGEN, POLYETHYLENE GLYCOL, AND GAMMA GLOBULIN BAXTER TRAVENOL LABORATORIES, INC. (US) 1976-11-30 US claimed
US-3980764-A Polymeric competitive protein binding adsorbents for radioassey CURTIS NUCLEAR CORPORATION (US) 1976-09-14 US claimed
US-3939259-A GELATIN CAPSULE, ZEIN, SHELLAC, ETHYL CELLULOSE, BEESWAX COATINGS PESCETTI ANTHONY 1976-02-17 US claimed