BDBM50134325 CHEMBL440159::Phenyl-acetic acid (1R,3R,5S)-8-(4-bromo-benzenesulfonylaminocarbonyl)-8-aza-bicyclo[3.2.1]oct-3-yl ester

SMILES: Brc1ccc(cc1)S(=O)(=O)NC(=O)N1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)Cc1ccccc1

InChI Key: InChIKey=CZEFQTBSZRBFMF-BWTSREIZSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50134325   

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))	BDBM50134325 (CHEMBL440159 | Phenyl-acetic acid (1R,3R,5S)-8-(4-...) Show SMILES Brc1ccc(cc1)S(=O)(=O)NC(=O)N1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)Cc1ccccc1 |THB:11:13:20.18.19:15.16| Show InChI InChI=1S/C22H23BrN2O5S/c23-16-6-10-20(11-7-16)31(28,29)24-22(27)25-17-8-9-18(25)14-19(13-17)30-21(26)12-15-4-2-1-3-5-15/h1-7,10-11,17-19H,8-9,12-14H2,(H,24,27)/t17-,18+,19+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Research Institute Vienna Curated by ChEMBL					Assay Description Inhibitory activity against Steroid sulfatase expressed in CHO cells				Bioorg Med Chem Lett 13: 3673-7 (2003) BindingDB Entry DOI: 10.7270/Q27S7N5G
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50134325 (CHEMBL440159 | Phenyl-acetic acid (1R,3R,5S)-8-(4-...) Show SMILES Brc1ccc(cc1)S(=O)(=O)NC(=O)N1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)Cc1ccccc1 |THB:11:13:20.18.19:15.16| Show InChI InChI=1S/C22H23BrN2O5S/c23-16-6-10-20(11-7-16)31(28,29)24-22(27)25-17-8-9-18(25)14-19(13-17)30-21(26)12-15-4-2-1-3-5-15/h1-7,10-11,17-19H,8-9,12-14H2,(H,24,27)/t17-,18+,19+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Research Institute Vienna Curated by ChEMBL					Assay Description Inhibitory activity against Steroid sulfatase expressed in CHO cells				Bioorg Med Chem Lett 13: 3673-7 (2003) BindingDB Entry DOI: 10.7270/Q27S7N5G
					More data for this Ligand-Target Pair