null

SMILES: CCOc1ccc(CN2CCN(CC2)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC

InChI Key: InChIKey=SSLWGDKUWZMHJB-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 38538   

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
Mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38538 (MLS000031179 | N-[4-[4-(4-ethoxy-3-methoxy-benzyl)...) Show SMILES CCOc1ccc(CN2CCN(CC2)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC Show InChI InChI=1S/C22H29N3O5S/c1-4-30-21-10-5-18(15-22(21)29-3)16-24-11-13-25(14-12-24)31(27,28)20-8-6-19(7-9-20)23-17(2)26/h5-10,15H,4,11-14,16H2,1-3H3,(H,23,26)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q27P8WSS
					More data for this Ligand-Target Pair
Mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38538 (MLS000031179 | N-[4-[4-(4-ethoxy-3-methoxy-benzyl)...) Show SMILES CCOc1ccc(CN2CCN(CC2)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC Show InChI InChI=1S/C22H29N3O5S/c1-4-30-21-10-5-18(15-22(21)29-3)16-24-11-13-25(14-12-24)31(27,28)20-8-6-19(7-9-20)23-17(2)26/h5-10,15H,4,11-14,16H2,1-3H3,(H,23,26)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.44E+5	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2CF9NG2
					More data for this Ligand-Target Pair
Mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38538 (MLS000031179 | N-[4-[4-(4-ethoxy-3-methoxy-benzyl)...) Show SMILES CCOc1ccc(CN2CCN(CC2)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC Show InChI InChI=1S/C22H29N3O5S/c1-4-30-21-10-5-18(15-22(21)29-3)16-24-11-13-25(14-12-24)31(27,28)20-8-6-19(7-9-20)23-17(2)26/h5-10,15H,4,11-14,16H2,1-3H3,(H,23,26)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q23X852V
					More data for this Ligand-Target Pair