BDBM50208827 2,3-bis(2-hydroxyethylthio)naphthalene-1,4-dione::CHEMBL429095::N1786 (NSC95397)::NSC 9539::NSC 95397::NSC-95397::cid_262093

SMILES: OCCSC1=C(SCCO)C(=O)c2ccccc2C1=O

InChI Key: InChIKey=MAASHDQFQDDECQ-UHFFFAOYSA-N

Data: 26 IC50  1 Kd  1 EC50

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 28 hits for monomerid = 50208827   

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
M-phase inducer phosphatase 3 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.77E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 3 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	56.9	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.49E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 7 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	780	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Large T antigen (SV40)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.82E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.79E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.79E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Caspase-9 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.83E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Apoptotic protease-activating factor 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Apoptotic protease-activating factor 1 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Phospholipase A2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-lactamase (Pseudomonas aeruginosa)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Toll-like receptor 9 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 1/Protein-glutamine gamma-glutamyltransferase 2 (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
Hexokinase HKDC1 [W721R] (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cysteine protease ATG4B (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Hexokinase HKDC1 [W721R] (Human)	BDBM50208827 (NSC-95397 | cid_262093 | N1786 (NSC95397) | CHEMBL...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair