BDBM50118559 CHEMBL341736::Sulfamic acid 2-adamantan-2-yl-4-oxo-4H-chromen-6-yl ester

SMILES: NS(=O)(=O)Oc1ccc2oc(cc(=O)c2c1)C1C2CC3CC(C2)CC1C3

InChI Key: InChIKey=IGDMTJIKWJHZGH-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50118559   

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))	BDBM50118559 (CHEMBL341736 | Sulfamic acid 2-adamantan-2-yl-4-ox...) Show SMILES NS(=O)(=O)Oc1ccc2oc(cc(=O)c2c1)C1C2CC3CC(C2)CC1C3 |TLB:10:16:18:21.22.20,THB:23:24:18:21.22.20,23:21:18:16.24.25,20:19:16:21.22.23,20:21:16:19.18.25,(2.57,-6.94,;3.91,-6.18,;2.75,-5.04,;4.66,-4.73,;5.26,-6.94,;6.6,-6.18,;6.6,-4.63,;7.94,-3.84,;9.28,-4.63,;10.62,-3.84,;11.96,-4.63,;11.96,-6.18,;10.62,-6.94,;10.61,-8.49,;9.27,-6.16,;7.94,-6.94,;13.3,-3.88,;13.49,-2.37,;12.7,-1.02,;14.24,-1.86,;15.67,-1.49,;16.47,-2.66,;15.02,-1.97,;16.26,-4.17,;14.78,-4.54,;14.1,-3.27,)| Show InChI InChI=1S/C19H21NO5S/c20-26(22,23)25-14-1-2-17-15(8-14)16(21)9-18(24-17)19-12-4-10-3-11(6-12)7-13(19)5-10/h1-2,8-13,19H,3-7H2,(H2,20,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Research Institute Vienna Curated by ChEMBL					Assay Description Inhibitory activity against purified human steroid sulfatase (STS)				J Med Chem 45: 4310-20 (2002) BindingDB Entry DOI: 10.7270/Q2BZ66SF
					More data for this Ligand-Target Pair