BDBM50504930 CHEMBL4515586

SMILES: NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br

InChI Key: InChIKey=XWTWKKFMRZDTAA-UHFFFAOYSA-N

Data: 24 Kd

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 24 hits for monomerid = 50504930   

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 (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 3 expressed in Escherichia coli expression system assessed as kinetic dissociation constant ...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 expressed in Escherichia coli expression system assessed as observed dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.290	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 4 expressed in Escherichia coli expression system assessed as kinetic dissociation constant ...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 6 expressed in Escherichia coli expression system assessed as observed dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 expressed in Escherichia coli expression system assessed as observed dissociation constan...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 6 expressed in Escherichia coli expression system assessed as kinetic dissociation constant ...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 13 expressed in Escherichia coli expression system assessed as observed dissociation constan...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase V (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 5a expressed in Escherichia coli expression system assessed as kinetic dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 expressed in Escherichia coli expression system assessed as observed dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase V (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.0300	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 5b expressed in Escherichia coli expression system assessed as kinetic dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 14 expressed in Escherichia coli expression system assessed as observed dissociation constan...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 4 expressed in Escherichia coli expression system assessed as observed dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 expressed in Escherichia coli expression system assessed as kinetic dissociation constant ...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.0100	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 7 expressed in Escherichia coli expression system assessed as kinetic dissociation constant ...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase V (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 5b expressed in Escherichia coli expression system assessed as observed dissociation constan...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.100	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 13 expressed in Escherichia coli expression system assessed as kinetic dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.0600	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 expressed in Escherichia coli expression system assessed as kinetic dissociation constant ...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 7 expressed in Escherichia coli expression system assessed as observed dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrases; II & IX (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 expressed in mammalian cell expression system assessed as observed dissociation constant f...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 3 expressed in Escherichia coli expression system assessed as observed dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase V (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 5a expressed in Escherichia coli expression system assessed as observed dissociation constan...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.0300	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 expressed in Escherichia coli expression system assessed as kinetic dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrase (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.0300	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 14 expressed in Escherichia coli expression system assessed as kinetic dissociation constant...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair
Carbonic anhydrases; II & IX (Homo sapiens (Human))	BDBM50504930 (CHEMBL4515586) Show SMILES NS(=O)(=O)c1cc(C(=O)NCCO)c(SCCc2ccccc2)cc1Br Show InChI InChI=1S/C17H19BrN2O4S2/c18-14-11-15(25-9-6-12-4-2-1-3-5-12)13(17(22)20-7-8-21)10-16(14)26(19,23)24/h1-5,10-11,21H,6-9H2,(H,20,22)(H2,19,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.00900	n/a	n/a	n/a	n/a	n/a
Vilnius University Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 expressed in mammalian cell expression system assessed as kinetic dissociation constant fl...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111825
					More data for this Ligand-Target Pair