BDBM52006 2-(2-aminocarbonylsulfanylethanoylamino)benzoic acid::2-[(2-carbamoylsulfanylacetyl)amino]benzoic acid::2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic acid::2-[[2-(carbamoylthio)acetyl]amino]benzoic acid::MLS000737416::SMR000528134::cid_224665

SMILES: c1ccc(c(c1)C(=O)O)NC(=O)CSC(=O)N

InChI Key: InChIKey=NWUAPELPCMQTDN-UHFFFAOYSA-N

Data: 5 IC50

PDB links: 2 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 5 hits for monomerid = 52006   

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
Beta-lactamase (Pseudomonas aeruginosa)	BDBM52006 (2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic aci...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-lactamase (Pseudomonas aeruginosa)	BDBM52006 (2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic aci...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.96E+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)	BDBM52006 (2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic aci...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.27E+3	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)	BDBM52006 (2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic aci...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cathepsin K (Human)	BDBM52006 (2-[[2-(carbamoylthio)-1-oxoethyl]amino]benzoic aci...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair