null

SMILES: NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)\N=C2/C(=O)N(Cc3ccc(cc3)C#N)c3ccccc23)cc1

InChI Key: InChIKey=PWDSWILKMGWZLG-MXNGAVTRSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50520833   

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))	BDBM50520833 (CHEMBL4569077) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)\N=C2/C(=O)N(Cc3ccc(cc3)C#N)c3ccccc23)cc1 Show InChI InChI=1S/C29H22N6O4S/c30-17-19-5-7-20(8-6-19)18-35-26-4-2-1-3-25(26)27(28(35)36)32-21-9-11-22(12-10-21)33-29(37)34-23-13-15-24(16-14-23)40(31,38)39/h1-16H,18H2,(H2,31,38,39)(H2,33,34,37)/b32-27-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kafrelsheikh University Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 by stopped flow CO2 hydration assay				Eur J Med Chem 162: 147-160 (2019) Article DOI: 10.1016/j.ejmech.2018.10.068 BindingDB Entry DOI: 10.7270/Q2FB56BZ
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50520833 (CHEMBL4569077) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)\N=C2/C(=O)N(Cc3ccc(cc3)C#N)c3ccccc23)cc1 Show InChI InChI=1S/C29H22N6O4S/c30-17-19-5-7-20(8-6-19)18-35-26-4-2-1-3-25(26)27(28(35)36)32-21-9-11-22(12-10-21)33-29(37)34-23-13-15-24(16-14-23)40(31,38)39/h1-16H,18H2,(H2,31,38,39)(H2,33,34,37)/b32-27-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kafrelsheikh University Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 1 by stopped flow CO2 hydration assay				Eur J Med Chem 162: 147-160 (2019) Article DOI: 10.1016/j.ejmech.2018.10.068 BindingDB Entry DOI: 10.7270/Q2FB56BZ
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50520833 (CHEMBL4569077) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)\N=C2/C(=O)N(Cc3ccc(cc3)C#N)c3ccccc23)cc1 Show InChI InChI=1S/C29H22N6O4S/c30-17-19-5-7-20(8-6-19)18-35-26-4-2-1-3-25(26)27(28(35)36)32-21-9-11-22(12-10-21)33-29(37)34-23-13-15-24(16-14-23)40(31,38)39/h1-16H,18H2,(H2,31,38,39)(H2,33,34,37)/b32-27-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	9.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kafrelsheikh University Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 by stopped flow CO2 hydration assay				Eur J Med Chem 162: 147-160 (2019) Article DOI: 10.1016/j.ejmech.2018.10.068 BindingDB Entry DOI: 10.7270/Q2FB56BZ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50520833 (CHEMBL4569077) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)\N=C2/C(=O)N(Cc3ccc(cc3)C#N)c3ccccc23)cc1 Show InChI InChI=1S/C29H22N6O4S/c30-17-19-5-7-20(8-6-19)18-35-26-4-2-1-3-25(26)27(28(35)36)32-21-9-11-22(12-10-21)33-29(37)34-23-13-15-24(16-14-23)40(31,38)39/h1-16H,18H2,(H2,31,38,39)(H2,33,34,37)/b32-27-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	207	n/a	n/a	n/a	n/a	n/a	n/a
Kafrelsheikh University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin) using poly[Glu:Tyr] (4:1) as substrate measured after 5 mins by Alphascreen assay				Eur J Med Chem 162: 147-160 (2019) Article DOI: 10.1016/j.ejmech.2018.10.068 BindingDB Entry DOI: 10.7270/Q2FB56BZ
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50520833 (CHEMBL4569077) Show SMILES NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)\N=C2/C(=O)N(Cc3ccc(cc3)C#N)c3ccccc23)cc1 Show InChI InChI=1S/C29H22N6O4S/c30-17-19-5-7-20(8-6-19)18-35-26-4-2-1-3-25(26)27(28(35)36)32-21-9-11-22(12-10-21)33-29(37)34-23-13-15-24(16-14-23)40(31,38)39/h1-16H,18H2,(H2,31,38,39)(H2,33,34,37)/b32-27-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	77	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kafrelsheikh University Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 2 by stopped flow CO2 hydration assay				Eur J Med Chem 162: 147-160 (2019) Article DOI: 10.1016/j.ejmech.2018.10.068 BindingDB Entry DOI: 10.7270/Q2FB56BZ
					More data for this Ligand-Target Pair