BDBM50003249 4-[2-(Isobutylamino-methyl)-benzenesulfonyl]-thiophene-2-sulfonic acid amide; hydrochloride::CHEMBL555588

SMILES: CC(C)CNCc1ccccc1S(=O)(=O)c1csc(c1)S(N)(=O)=O

InChI Key: InChIKey=AKJABWRAOULPJF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50003249   

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))	BDBM50003249 (4-[2-(Isobutylamino-methyl)-benzenesulfonyl]-thiop...) Show SMILES CC(C)CNCc1ccccc1S(=O)(=O)c1csc(c1)S(N)(=O)=O Show InChI InChI=1S/C15H20N2O4S3/c1-11(2)8-17-9-12-5-3-4-6-14(12)23(18,19)13-7-15(22-10-13)24(16,20)21/h3-7,10-11,17H,8-9H2,1-2H3,(H2,16,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase II				J Med Chem 35: 3822-31 (1992) BindingDB Entry DOI: 10.7270/Q2ZG6SV4
					More data for this Ligand-Target Pair