BDBM16436 6,8-disulfanyloctanoic acid::D,L-Dihydrolipoic acid::Dihydrothioctic acid::dihydrolipoate

SMILES: C(CCC(=O)O)C[C@H](CCS)S

InChI Key: InChIKey=IZFHEQBZOYJLPK-UHFFFAOYSA-N

Data: 1 KI

PDB links: 8 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 16436   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Aldo-keto reductase family 1 member B1 (Human)	BDBM16436 (6,8-disulfanyloctanoic acid | dihydrolipoate | Dih...) Show SMILES Show InChI	GoogleScholar	UniChem		950	-8.21	n/a	n/a	n/a	n/a	n/a	7.0	25
TBA									Citation and Details
					More data for this Ligand-Target Pair