BindingDB PrimarySearch

BDBM46356 DIGITOXIN::MLS000069787::SMR000058529::US10668094, Compound Digitoxin::cid_441207

SMILES: C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)C)C)C)O)O

InChI Key: InChIKey=WDJUZGPOPHTGOT-UHFFFAOYSA-N

Data: 4 KI 10 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 46356
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Signal transducer and activator of transcription 3 [702-738,740-752] (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
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Signal transducer and activator of transcription 1-alpha/beta (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>5.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
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TBA				More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 2 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 4 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 3 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	3.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Solute carrier organic anion transporter family member 4C1 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
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Sodium/potassium-transporting ATPase subunit alpha-1 (Dog)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Sodium/potassium-transporting ATPase subunit alpha-2/beta-3 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	28.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Sodium/potassium-transporting ATPase subunit alpha-2/beta-1 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	29.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Sodium/potassium-transporting ATPase subunit alpha-2/beta-2 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	40.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Sodium/potassium-transporting ATPase subunit alpha-1/beta-1 (Human)	BDBM46356 (SMR000058529 \| cid_441207 \| MLS000069787 \| DIGITOX...) Show SMILES Show InChI	GoogleScholar	UniChem	89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair