BDBM50154327 (S)-3-Phenyl-2-[3-(4-sulfamoyl-phenyl)-thioureido]-propionic acid::CHEMBL366098

SMILES: NS(=O)(=O)c1ccc(NC(=S)N[C@@H](Cc2ccccc2)C(O)=O)cc1

InChI Key: InChIKey=XLMNAJDPYXDADN-AWEZNQCLSA-N

Data: 2 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 2 hits for monomerid = 50154327   

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))	BDBM50154327 ((S)-3-Phenyl-2-[3-(4-sulfamoyl-phenyl)-thioureido]...) Show SMILES NS(=O)(=O)c1ccc(NC(=S)N[C@@H](Cc2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C16H17N3O4S2/c17-25(22,23)13-8-6-12(7-9-13)18-16(24)19-14(15(20)21)10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H,20,21)(H2,17,22,23)(H2,18,19,24)/t14-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibitory activity against human Carbonic anhydrase II				J Med Chem 47: 5224-9 (2004) Article DOI: 10.1021/jm049692i BindingDB Entry DOI: 10.7270/Q24F1RHJ
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50154327 ((S)-3-Phenyl-2-[3-(4-sulfamoyl-phenyl)-thioureido]...) Show SMILES NS(=O)(=O)c1ccc(NC(=S)N[C@@H](Cc2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C16H17N3O4S2/c17-25(22,23)13-8-6-12(7-9-13)18-16(24)19-14(15(20)21)10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H,20,21)(H2,17,22,23)(H2,18,19,24)/t14-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibitory activity against human Carbonic anhydrase I				J Med Chem 47: 5224-9 (2004) Article DOI: 10.1021/jm049692i BindingDB Entry DOI: 10.7270/Q24F1RHJ
					More data for this Ligand-Target Pair