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BDBM10515 5-(1,2-dithiolan-3-yl)pentanoic acid::CHEMBL33864::D,L-Lipoic acid::D,L-Thioctic acid::cid_864::lipoic acid (LA)

SMILES: OC(=O)CCCCC1CCSS1

InChI Key: InChIKey=AGBQKNBQESQNJD-UHFFFAOYSA-N

Data: 1 KI 5 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 10515
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Acetylcholinesterase (Human)	BDBM10515 (5-(1,2-dithiolan-3-yl)pentanoic acid \| D,L-Lipoic ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	8.0	37
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Cholinesterase (Human)	BDBM10515 (5-(1,2-dithiolan-3-yl)pentanoic acid \| D,L-Lipoic ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	8.0	37
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Phosphotransferase (Trypanosoma brucei brucei (strain 927/4 GUTat10.1))	BDBM10515 (5-(1,2-dithiolan-3-yl)pentanoic acid \| D,L-Lipoic ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	201	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Eukaryotic translation initiation factor 4 gamma 1 (Human)	BDBM10515 (5-(1,2-dithiolan-3-yl)pentanoic acid \| D,L-Lipoic ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
SUMO-activating enzyme subunit 1 (Human)	BDBM10515 (5-(1,2-dithiolan-3-yl)pentanoic acid \| D,L-Lipoic ...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Human)	BDBM10515 (5-(1,2-dithiolan-3-yl)pentanoic acid \| D,L-Lipoic ...) Show SMILES Show InChI	GoogleScholar	UniChem		2.55E+4	-6.26	n/a	n/a	n/a	n/a	n/a	7.0	25
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair