BDBM50161118 4-(4-Chloro-benzenesulfonylaminocarbonyl)-piperazine-1-carboxylic acid tert-butyl ester::CHEMBL361614

SMILES: CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NS(=O)(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=NTYSFPBQYUYKAR-UHFFFAOYSA-N

Data: 1 KI  2 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 3 hits for monomerid = 50161118   

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
Steryl-sulfatase (Homo sapiens (Human))	BDBM50161118 (4-(4-Chloro-benzenesulfonylaminocarbonyl)-piperazi...) Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C16H22ClN3O5S/c1-16(2,3)25-15(22)20-10-8-19(9-11-20)14(21)18-26(23,24)13-6-4-12(17)5-7-13/h4-7H,8-11H2,1-3H3,(H,18,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.45E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibitory constant against human steroid sulfatase				Bioorg Med Chem Lett 15: 1235-8 (2005) Article DOI: 10.1016/j.bmcl.2004.11.069 BindingDB Entry DOI: 10.7270/Q2RF5THG
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50161118 (4-(4-Chloro-benzenesulfonylaminocarbonyl)-piperazi...) Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C16H22ClN3O5S/c1-16(2,3)25-15(22)20-10-8-19(9-11-20)14(21)18-26(23,24)13-6-4-12(17)5-7-13/h4-7H,8-11H2,1-3H3,(H,18,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibitory concentration against human steroid sulfatase				Bioorg Med Chem Lett 15: 1235-8 (2005) Article DOI: 10.1016/j.bmcl.2004.11.069 BindingDB Entry DOI: 10.7270/Q2RF5THG
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50161118 (4-(4-Chloro-benzenesulfonylaminocarbonyl)-piperazi...) Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C16H22ClN3O5S/c1-16(2,3)25-15(22)20-10-8-19(9-11-20)14(21)18-26(23,24)13-6-4-12(17)5-7-13/h4-7H,8-11H2,1-3H3,(H,18,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Inhibitory concentration against human steroid sulfatase expressed in CHO cells				Bioorg Med Chem Lett 15: 1235-8 (2005) Article DOI: 10.1016/j.bmcl.2004.11.069 BindingDB Entry DOI: 10.7270/Q2RF5THG
					More data for this Ligand-Target Pair