null

SMILES: NNC(=O)c1cn(nc1-c1ccc(cc1)[N+]([O-])=O)-c1ccc(cc1)S(N)(=O)=O

InChI Key: InChIKey=MGLPPIXXHJPCHI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50496531   

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 12 (Homo sapiens (Human))	BDBM50496531 (CHEMBL3126809) Show SMILES NNC(=O)c1cn(nc1-c1ccc(cc1)[N+]([O-])=O)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H14N6O5S/c17-19-16(23)14-9-21(11-5-7-13(8-6-11)28(18,26)27)20-15(14)10-1-3-12(4-2-10)22(24)25/h1-9H,17H2,(H,19,23)(H2,18,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 12-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay				Eur J Med Chem 76: 284-90 (2014) Article DOI: 10.1016/j.ejmech.2014.02.023 BindingDB Entry DOI: 10.7270/Q2833W01
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50496531 (CHEMBL3126809) Show SMILES NNC(=O)c1cn(nc1-c1ccc(cc1)[N+]([O-])=O)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H14N6O5S/c17-19-16(23)14-9-21(11-5-7-13(8-6-11)28(18,26)27)20-15(14)10-1-3-12(4-2-10)22(24)25/h1-9H,17H2,(H,19,23)(H2,18,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 1-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay				Eur J Med Chem 76: 284-90 (2014) Article DOI: 10.1016/j.ejmech.2014.02.023 BindingDB Entry DOI: 10.7270/Q2833W01
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50496531 (CHEMBL3126809) Show SMILES NNC(=O)c1cn(nc1-c1ccc(cc1)[N+]([O-])=O)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H14N6O5S/c17-19-16(23)14-9-21(11-5-7-13(8-6-11)28(18,26)27)20-15(14)10-1-3-12(4-2-10)22(24)25/h1-9H,17H2,(H,19,23)(H2,18,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay				Eur J Med Chem 76: 284-90 (2014) Article DOI: 10.1016/j.ejmech.2014.02.023 BindingDB Entry DOI: 10.7270/Q2833W01
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50496531 (CHEMBL3126809) Show SMILES NNC(=O)c1cn(nc1-c1ccc(cc1)[N+]([O-])=O)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H14N6O5S/c17-19-16(23)14-9-21(11-5-7-13(8-6-11)28(18,26)27)20-15(14)10-1-3-12(4-2-10)22(24)25/h1-9H,17H2,(H,19,23)(H2,18,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay				Eur J Med Chem 76: 284-90 (2014) Article DOI: 10.1016/j.ejmech.2014.02.023 BindingDB Entry DOI: 10.7270/Q2833W01
					More data for this Ligand-Target Pair