BDBM50051829 4-methyl-2-oxo-2H-chromen-7-yl sulfamate::CHEMBL11185::Sulfamic acid 4-methyl-2-oxo-2H-chromen-7-yl ester

SMILES: Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12

InChI Key: InChIKey=UFGBGFMPBMEVMI-UHFFFAOYSA-N

Data: 1 KI  13 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 14 hits for monomerid = 50051829   

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
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of recombinant human cytosolic isozyme CA II				Bioorg Med Chem Lett 15: 5192-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.102 BindingDB Entry DOI: 10.7270/Q20002VN
					More data for this Ligand-Target Pair				3D Structure (docked)
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibitory activity against estrone sulfatase enzyme				Bioorg Med Chem Lett 9: 1645-50 (1999) BindingDB Entry DOI: 10.7270/Q23R0TC0
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hans-Kn�ll Institute of Natural Products Research Curated by ChEMBL					Assay Description Inhibitory activity againist Estrone sulfatase from MCF-7 cells (placental microsomes)				Bioorg Med Chem Lett 12: 1339-42 (2002) BindingDB Entry DOI: 10.7270/Q27D2VNJ
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibitory activity against Estrone Sulfatase				Bioorg Med Chem Lett 12: 2391-4 (2002) BindingDB Entry DOI: 10.7270/Q2S75GV2
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibition of estrone sulfatase (ES)				Bioorg Med Chem Lett 11: 2525-8 (2001) BindingDB Entry DOI: 10.7270/Q2CF9QMP
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Tested for the inhibitory activity against Estrone Sulfatase				Bioorg Med Chem Lett 11: 3001-5 (2001) BindingDB Entry DOI: 10.7270/Q2W959QT
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of steroid sulfatase (unknown origin)				Eur J Med Chem 179: 257-271 (2019) Article DOI: 10.1016/j.ejmech.2019.06.052
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibition of Estrone sulfatase				Bioorg Med Chem Lett 11: 841-4 (2001) BindingDB Entry DOI: 10.7270/Q2JW8FFS
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibition of estrone sulfatase				Bioorg Med Chem Lett 14: 605-9 (2004) BindingDB Entry DOI: 10.7270/Q2H132K6
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibitory activity against Estrone sulfatase (E1-STS) in MCF-7 breast cancer cells at 0.1 uM				J Med Chem 39: 1349-51 (1996) Article DOI: 10.1021/jm950931z BindingDB Entry DOI: 10.7270/Q218375Z
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Compound was evaluated for its inhibitory activity against estrone sulfatase enzyme				Bioorg Med Chem Lett 12: 1343-6 (2002) BindingDB Entry DOI: 10.7270/Q23N23X6
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of placental microsomal steroid sulfatase (unknown origin)				Eur J Med Chem 128: 79-87 (2017) Article DOI: 10.1016/j.ejmech.2017.01.028 BindingDB Entry DOI: 10.7270/Q2KD21WV
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibition of STS activity in human MCF7 cells				J Med Chem 58: 7634-58 (2015) BindingDB Entry DOI: 10.7270/Q2474CP9
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50051829 (4-methyl-2-oxo-2H-chromen-7-yl sulfamate | CHEMBL1...) Show SMILES Cc1cc(=O)oc2cc(OS(N)(=O)=O)ccc12 Show InChI InChI=1S/C10H9NO5S/c1-6-4-10(12)15-9-5-7(2-3-8(6)9)16-17(11,13)14/h2-5H,1H3,(H2,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description In vitro inhibition of estrone sulfatase.				Bioorg Med Chem Lett 12: 1279-82 (2002) BindingDB Entry DOI: 10.7270/Q2MC90K1
					More data for this Ligand-Target Pair