BDBM65978 MLS000690454::N-[({4-[(dimethylamino)sulfonyl]phenyl}amino)carbonothioyl]-2-phenylacetamide::N-[[4-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]-2-phenylacetamide::N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]-2-phenyl-ethanamide::N-[[4-(dimethylsulfamoyl)phenyl]carbamothioyl]-2-phenylacetamide::N-[[4-(dimethylsulfamoyl)phenyl]thiocarbamoyl]-2-phenyl-acetamide::SMR000300303::cid_2214684

SMILES: CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1

InChI Key: InChIKey=KAHBTDGMUYLGIF-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 65978   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Alkanal monooxygenase alpha chain (Vibrio harveyi)	BDBM65978 (MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...) Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Quorum Sensing,Auto-inducer 2(AI-2),Vibrio harveyi,LuxS,LuxPQ,LuxO,LuxU,luciferase,Luminescence Assay Overview: A modified strain of Vibri...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q22R3Q4F
					More data for this Ligand-Target Pair
LuxS (Vibrio harveyi)	BDBM65978 (MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...) Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	UniProtKB/TrEMBL GoogleScholar	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS, LuxPQ, Luminescence Assay Overview: A modified strain of Vibrio harveyi with ...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2Z036M0
					More data for this Ligand-Target Pair
LuxS (Vibrio harveyi)	BDBM65978 (MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...) Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	UniProtKB/TrEMBL GoogleScholar	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>3.50E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: LuxS enzyme, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathway in Vibrio harveyi...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q23F4N29
					More data for this Ligand-Target Pair
Alkanal monooxygenase alpha chain (Vibrio harveyi)	BDBM65978 (MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...) Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase PC cid PC sid UniChem	Article PCBioAssay	n/a	n/a	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS,LuxPQ,LuxO,LuxU,LuxR,luciferase,Luminescence Assay Overview: A modified strain ...				PubChem Bioassay (2010) Article DOI: 10.1021/bi400179m BindingDB Entry DOI: 10.7270/Q2PG1Q5Z
					More data for this Ligand-Target Pair
Alkanal monooxygenase alpha chain (Vibrio harveyi)	BDBM65978 (MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...) Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Quorum Sensing, LuxPQ receptor, AI-2 Assay Overview: The overall aim of the project is to identify inhibitors of the quorum sensing pathwa...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2736PC9
					More data for this Ligand-Target Pair
LuxS (Vibrio harveyi)	BDBM65978 (MLS000690454 | N-[({4-[(dimethylamino)sulfonyl]phe...) Show SMILES CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1 Show InChI InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	UniProtKB/TrEMBL GoogleScholar	Purchase PC cid PC sid UniChem	Article PCBioAssay	n/a	n/a	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Quorum Sensing, Auto-inducer 2 (AI-2), Vibrio harveyi, LuxS, LuxPQ, Luminescence Assay Overview: A modified strain of Vibrio harveyi with ...				PubChem Bioassay (2010) Article DOI: 10.1016/j.bioorg.2014.03.008 BindingDB Entry DOI: 10.7270/Q2T72FW8
					More data for this Ligand-Target Pair