BDBM50094828 3-Hydroxy-3-phenyl-2-[3-(4-sulfamoyl-phenyl)-thioureido]-propionic acid::CHEMBL144946

SMILES: NS(=O)(=O)c1ccc(NC(=S)NC(C(O)c2ccccc2)C(O)=O)cc1

InChI Key: InChIKey=MTEAPQJRNVJOCS-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 = 50094828   

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))	BDBM50094828 (3-Hydroxy-3-phenyl-2-[3-(4-sulfamoyl-phenyl)-thiou...) Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC(C(O)c2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C16H17N3O5S2/c17-26(23,24)12-8-6-11(7-9-12)18-16(25)19-13(15(21)22)14(20)10-4-2-1-3-5-10/h1-9,13-14,20H,(H,21,22)(H2,17,23,24)(H2,18,19,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	2	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 Inhibitory activity against human recombinant carbonic anhydrase II				J Med Chem 43: 4884-92 (2000) BindingDB Entry DOI: 10.7270/Q22B8ZQQ
					More data for this Ligand-Target Pair
Carbonic Anhydrase IV (Bos taurus (bovine))	BDBM50094828 (3-Hydroxy-3-phenyl-2-[3-(4-sulfamoyl-phenyl)-thiou...) Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC(C(O)c2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C16H17N3O5S2/c17-26(23,24)12-8-6-11(7-9-12)18-16(25)19-13(15(21)22)14(20)10-4-2-1-3-5-10/h1-9,13-14,20H,(H,21,22)(H2,17,23,24)(H2,18,19,25)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	9	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 Inhibitory activity against bovine carbonic anhydrase IV from lung microsomes				J Med Chem 43: 4884-92 (2000) BindingDB Entry DOI: 10.7270/Q22B8ZQQ
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50094828 (3-Hydroxy-3-phenyl-2-[3-(4-sulfamoyl-phenyl)-thiou...) Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC(C(O)c2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C16H17N3O5S2/c17-26(23,24)12-8-6-11(7-9-12)18-16(25)19-13(15(21)22)14(20)10-4-2-1-3-5-10/h1-9,13-14,20H,(H,21,22)(H2,17,23,24)(H2,18,19,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	24	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 Inhibitory activity against human recombinant carbonic anhydrase I				J Med Chem 43: 4884-92 (2000) BindingDB Entry DOI: 10.7270/Q22B8ZQQ
					More data for this Ligand-Target Pair