Ouabain

Ouabain

SCHEMBL230974

CC1OC(O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@@H](O)C(O)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 1.00
TP53 P04637 7/20 1.00
LMNA P02545 5/20 1.00
HIF1A Q16665 5/20 1.00
NPC1 O15118 4/20 1.00
RAB9A P51151 4/20 1.00
GMNN O75496 2/20 1.00
KLF5 Q13887 2/20 1.00
TSHR P16473 2/20 1.00
NFKB1 P19838 2/20 1.00
ATP1A1 P05023 2/20 1.00
ATP1B1 P05026 2/20 1.00
ATP1A3 P13637 2/20 1.00
ATP1B2 P14415 2/20 1.00
ATP1A2 P50993 2/20 1.00
ATP1B3 P54709 2/20 1.00
FXYD2 P54710 2/20 1.00
ATP1A4 Q13733 2/20 1.00
CYP2C19 P33261 1/20 1.00
CYP1A2 P05177 1/20 1.00

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
Ouabain SCHEMBL14633742 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL17936503 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL2318232 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL10044992 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL24444049 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL18922524 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL24951415 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL21960066 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL21960068 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1
Ouabain SCHEMBL22824877 1.00 SMN1; SMN2 (1.00) SMN1; SMN2TP53LMNAHIF1ANPC1

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 461 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-4387991-A1 HYBRID TUMOR/CANCER THERAPY BASED ON TARGETING THE RESOLUTION OF OR INDUCING TRANSCRIPTION-REPLICATION CONFLICTS (TRCS) Julius-Maximilians-Universität Würzburg (DE) 2024-06-26 EP claimed
WO-2023021113-A1 HYBRID TUMOR/CANCER THERAPY BASED ON TARGETING THE RESOLUTION OF OR INDUCING TRANSCRIPTION-REPLICATION CONFLICTS (TRCS) JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2023-02-23 WO claimed
CN-109806268-B Application of ouabain in preparing medicine for treating non-alcoholic fatty liver disease 南京大学 2022-11-29 CN claimed
US-20220193053-A1 CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR MODULATORS FOR TREATING AUTOSOMAL DOMINANT POLYCYSTIC KIDNEY DISEASE THE JOHNS HOPKINS UNIVERSITY 2022-06-23 US claimed
CN-110960543-A anti-VEGF-anti-PD 1 combined bispecific antibody for preparing anti-cancer drug 安徽瀚海博兴生物技术有限公司 2020-04-07 CN claimed
WO-2010068461-A1 CO-ADMINISTRATION OF RANOLAZINE AND CARDIAC GLYCOSIDES GILEAD PALO ALTO, INC. (US) 2010-06-17 WO claimed
US-20100130436-A1 CO-ADMINISTRATION OF RANOLAZINE AND CARDIAC GLYCOSIDES GILEAD PALO ALTO, INC. (US) 2010-05-27 US claimed
US-7723053-B2 High-throughput screen for identifying selective persistent sodium channels channel blockers ALLERGAN, INC. (US) 2010-05-25 US claimed
WO-2010048273-A2 METHODS AND COMPOUNDS FOR TREATMENT OF NEURODEGENERATIVE DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-04-29 WO claimed
WO-2004072278-A1 CARDIAC GLYCOSIDE RESISTANT NON-IMMUNOGENIC SELECTION MARKER AVARIS AB (SE) 2004-08-26 WO claimed
EP-0778768-B1 FORMULATIONS AND METHODS FOR PROVIDING PROLONGED LOCAL ANESTHESIA EURO CELTIQUE SA (LU) 2004-05-26 EP claimed
EP-1196177-A2 USES OF OUABAIN AND OUABAIN-LIKE MOLECULES IN APOPTOSIS RELATED PATHOLOGIES Corporation du Centre de Recerche du Centre Hospitalier de l'universite de Montreal (CA) 2002-04-17 EP claimed
US-6190921-B1 Ouabain immunoassay and kit and ouabain labeled with 125I or fluorescent label LEPPAELUOTO PEKKA JUHANI (FI) 2001-02-20 US claimed
WO-2000074700-A2 USES OF OUABAIN AND OUABAIN-LIKE MOLECULES IN APOPTOSIS RELATED PATHOLOGIES CORPORATION DU CENTRE DE RECHERCHE DU CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2000-12-14 WO claimed
EP-0988373-A1 SELECTION MARKER Karolinska Innovations AB (SE) 2000-03-29 EP claimed
WO-1998055603-A1 NEW SELECTION MARKER KAROLINSKA INNOVATIONS AB (SE) 1998-12-10 WO claimed
US-5543157-A PHARMACEUTICAL INCLUSION COMPOUNDS PROVIDING FAST RELEASE OF DRUG WHEN WETTED WITH WATER, E.G. BODY FLUIDS THE PROCTER & GAMBLE COMPANY (US) 1996-08-06 US claimed
EP-0442744-A2 Treatment of viral disease by glycosides TSUMURA & CO. (JP) 1991-08-21 EP claimed
US-4434236-A Immunoassay wherein labeled antibody is displaced from immobilized analyte-analogue E. I. DU PONT DE NEMOURS & CO. (US) 1984-02-28 US claimed