BDBM50531524 CHEMBL4551727

SMILES: NS(=O)(=O)c1ccc(cc1)-c1noc(n1)-c1cccs1

InChI Key: InChIKey=CKHCRDBKFLEBMZ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50531524   

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))	BDBM50531524 (CHEMBL4551727) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1noc(n1)-c1cccs1 Show InChI InChI=1S/C12H9N3O3S2/c13-20(16,17)9-5-3-8(4-6-9)11-14-12(18-15-11)10-2-1-7-19-10/h1-7H,(H2,13,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9 assessed as reduction in CO2 hydration after 15 mins by phenol red staining-based stopped flow assay				Eur J Med Chem 164: 92-105 (2019) Article DOI: 10.1016/j.ejmech.2018.12.049
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50531524 (CHEMBL4551727) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1noc(n1)-c1cccs1 Show InChI InChI=1S/C12H9N3O3S2/c13-20(16,17)9-5-3-8(4-6-9)11-14-12(18-15-11)10-2-1-7-19-10/h1-7H,(H2,13,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 assessed as reduction in CO2 hydration after 15 mins by phenol red staining-based stopped flow assay				Eur J Med Chem 164: 92-105 (2019) Article DOI: 10.1016/j.ejmech.2018.12.049
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50531524 (CHEMBL4551727) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1noc(n1)-c1cccs1 Show InChI InChI=1S/C12H9N3O3S2/c13-20(16,17)9-5-3-8(4-6-9)11-14-12(18-15-11)10-2-1-7-19-10/h1-7H,(H2,13,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 1 assessed as reduction in CO2 hydration after 15 mins by phenol red staining-based stopped flow assay				Eur J Med Chem 164: 92-105 (2019) Article DOI: 10.1016/j.ejmech.2018.12.049
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50531524 (CHEMBL4551727) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1noc(n1)-c1cccs1 Show InChI InChI=1S/C12H9N3O3S2/c13-20(16,17)9-5-3-8(4-6-9)11-14-12(18-15-11)10-2-1-7-19-10/h1-7H,(H2,13,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 12 assessed as reduction in CO2 hydration after 15 mins by phenol red staining-based stopped flow assay				Eur J Med Chem 164: 92-105 (2019) Article DOI: 10.1016/j.ejmech.2018.12.049
					More data for this Ligand-Target Pair