null

SMILES: CC(C)c1cc(cc(C(C)C)[n+]1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1

InChI Key: InChIKey=QGHYQEDLTBUOJJ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50141793   

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))	BDBM50141793 (2,6-Diisopropyl-4-phenyl-1-(4-sulfamoyl-phenyl)-py...) Show SMILES CC(C)c1cc(cc(C(C)C)[n+]1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1 Show InChI InChI=1S/C23H27N2O2S/c1-16(2)22-14-19(18-8-6-5-7-9-18)15-23(17(3)4)25(22)20-10-12-21(13-11-20)28(24,26)27/h5-17H,1-4H3,(H2,24,26,27)/q+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Slovak Academy of Sciences Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase II				Bioorg Med Chem Lett 14: 869-73 (2004) Article DOI: 10.1016/j.bmcl.2003.12.029 BindingDB Entry DOI: 10.7270/Q24M953W
					More data for this Ligand-Target Pair
Carbonic anhydrase 4 (Bos taurus (bovine))	BDBM50141793 (2,6-Diisopropyl-4-phenyl-1-(4-sulfamoyl-phenyl)-py...) Show SMILES CC(C)c1cc(cc(C(C)C)[n+]1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1 Show InChI InChI=1S/C23H27N2O2S/c1-16(2)22-14-19(18-8-6-5-7-9-18)15-23(17(3)4)25(22)20-10-12-21(13-11-20)28(24,26)27/h5-17H,1-4H3,(H2,24,26,27)/q+1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Slovak Academy of Sciences Curated by ChEMBL					Assay Description Inhibitory activity against carbonic anhydrase IV from bovine lung microsomes				Bioorg Med Chem Lett 14: 869-73 (2004) Article DOI: 10.1016/j.bmcl.2003.12.029 BindingDB Entry DOI: 10.7270/Q24M953W
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50141793 (2,6-Diisopropyl-4-phenyl-1-(4-sulfamoyl-phenyl)-py...) Show SMILES CC(C)c1cc(cc(C(C)C)[n+]1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1 Show InChI InChI=1S/C23H27N2O2S/c1-16(2)22-14-19(18-8-6-5-7-9-18)15-23(17(3)4)25(22)20-10-12-21(13-11-20)28(24,26)27/h5-17H,1-4H3,(H2,24,26,27)/q+1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Slovak Academy of Sciences Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase IX				Bioorg Med Chem Lett 14: 869-73 (2004) Article DOI: 10.1016/j.bmcl.2003.12.029 BindingDB Entry DOI: 10.7270/Q24M953W
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50141793 (2,6-Diisopropyl-4-phenyl-1-(4-sulfamoyl-phenyl)-py...) Show SMILES CC(C)c1cc(cc(C(C)C)[n+]1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1 Show InChI InChI=1S/C23H27N2O2S/c1-16(2)22-14-19(18-8-6-5-7-9-18)15-23(17(3)4)25(22)20-10-12-21(13-11-20)28(24,26)27/h5-17H,1-4H3,(H2,24,26,27)/q+1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Slovak Academy of Sciences Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase I				Bioorg Med Chem Lett 14: 869-73 (2004) Article DOI: 10.1016/j.bmcl.2003.12.029 BindingDB Entry DOI: 10.7270/Q24M953W
					More data for this Ligand-Target Pair