BDBM50288895 4-Methylsulfanyl-2-{2-[2-(4-sulfamoyl-benzoylamino)-acetylamino]-acetylamino}-butyric acid::CHEMBL2371071

SMILES: CSCC[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O

InChI Key: InChIKey=DXONCZREXSXETL-CYBMUJFWSA-N

Data: 1 Kd

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 = 50288895   

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))	BDBM50288895 (4-Methylsulfanyl-2-{2-[2-(4-sulfamoyl-benzoylamino...) Show SMILES CSCC[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O |r| Show InChI InChI=1S/C18H25N5O8S2/c1-32-7-6-13(18(28)29)23-16(26)10-21-14(24)8-20-15(25)9-22-17(27)11-2-4-12(5-3-11)33(19,30)31/h2-5,13H,6-10H2,1H3,(H,20,25)(H,21,24)(H,22,27)(H,23,26)(H,28,29)(H2,19,30,31)/t13-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Dissociation constant against human carbonic anhydrase II at 37 degree centigrade				Bioorg Med Chem Lett 6: 559-564 (1996) Article DOI: 10.1016/0960-894X(96)00069-8 BindingDB Entry DOI: 10.7270/Q2V124SF
					More data for this Ligand-Target Pair