BDBM50414944 CHEMBL121556::NSC-402538

SMILES: S=C(SSC(=S)N1CCOCC1)N1CCOCC1

InChI Key: InChIKey=KKVYOWPPMNSLCP-UHFFFAOYSA-N

Data: 3 KI  8 IC50

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 12 hits for monomerid = 50414944   

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
Fructose-1,6-bisphosphatase 1 (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) 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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Aldehyde dehydrogenase 1A1 (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Aldehyde dehydrogenase, mitochondrial (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (2019-nCoV)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
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D-3-phosphoglycerate dehydrogenase (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	49	n/a	n/a	n/a	n/a
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Fatty-acid amide hydrolase 1 (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Monoglyceride lipase (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	219	n/a	n/a	n/a	n/a	n/a	n/a
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		176	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		462	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 3, mitochondrial (Human)	BDBM50414944 (NSC-402538 | CHEMBL121556) Show SMILES Show InChI	GoogleScholar	UniChem		2.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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