null

SMILES: COC(=O)c1cn(nc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O

InChI Key: InChIKey=KXPAIVPXFVDMFH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50496540   

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 9 (Homo sapiens (Human))	BDBM50496540 (CHEMBL3126814) Show SMILES COC(=O)c1cn(nc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H15N3O4S/c1-24-17(21)15-11-20(19-16(15)12-5-3-2-4-6-12)13-7-9-14(10-8-13)25(18,22)23/h2-11H,1H3,(H2,18,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	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 1 (Homo sapiens (Human))	BDBM50496540 (CHEMBL3126814) Show SMILES COC(=O)c1cn(nc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H15N3O4S/c1-24-17(21)15-11-20(19-16(15)12-5-3-2-4-6-12)13-7-9-14(10-8-13)25(18,22)23/h2-11H,1H3,(H2,18,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	22	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 12 (Homo sapiens (Human))	BDBM50496540 (CHEMBL3126814) Show SMILES COC(=O)c1cn(nc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H15N3O4S/c1-24-17(21)15-11-20(19-16(15)12-5-3-2-4-6-12)13-7-9-14(10-8-13)25(18,22)23/h2-11H,1H3,(H2,18,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	23	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 2 (Homo sapiens (Human))	BDBM50496540 (CHEMBL3126814) Show SMILES COC(=O)c1cn(nc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H15N3O4S/c1-24-17(21)15-11-20(19-16(15)12-5-3-2-4-6-12)13-7-9-14(10-8-13)25(18,22)23/h2-11H,1H3,(H2,18,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	240	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