BDBM50222618 CHEMBL342368

SMILES: NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1

InChI Key: InChIKey=RGUZMHVZJGELMZ-UHFFFAOYSA-N

Data: 3 KI

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 = 50222618   

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))	BDBM50222618 (CHEMBL342368) Show SMILES NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1 Show InChI InChI=1S/C14H11N3O5S/c15-23(20,21)10-5-3-9(4-6-10)8-22-17-13(18)11-2-1-7-16-12(11)14(17)19/h1-7H,8H2,(H2,15,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
A.P.S. University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase II (CAII)				Bioorg Med Chem Lett 13: 447-53 (2003) BindingDB Entry DOI: 10.7270/Q2668GC9
					More data for this Ligand-Target Pair
Carbonic anhydrase (Bos taurus (bovine))	BDBM50222618 (CHEMBL342368) Show SMILES NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1 Show InChI InChI=1S/C14H11N3O5S/c15-23(20,21)10-5-3-9(4-6-10)8-22-17-13(18)11-2-1-7-16-12(11)14(17)19/h1-7H,8H2,(H2,15,20,21)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
A.P.S. University Curated by ChEMBL					Assay Description Inhibition of bovine carbonic anhydrase IV (CAIV)				Bioorg Med Chem Lett 13: 447-53 (2003) BindingDB Entry DOI: 10.7270/Q2668GC9
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50222618 (CHEMBL342368) Show SMILES NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1 Show InChI InChI=1S/C14H11N3O5S/c15-23(20,21)10-5-3-9(4-6-10)8-22-17-13(18)11-2-1-7-16-12(11)14(17)19/h1-7H,8H2,(H2,15,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.04E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
A.P.S. University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase I (CAI)				Bioorg Med Chem Lett 13: 447-53 (2003) BindingDB Entry DOI: 10.7270/Q2668GC9
					More data for this Ligand-Target Pair