BDBM50167412 CHEMBL382309::sulfanilamide derivative

SMILES: Cc1ccc2OC=C3CN(CCc4ccc(cc4)S(N)(=O)=O)[Zn]4(Cl)(Cl)(OC3c2c1)OC1C(CN4CCc2ccc(cc2)S(N)(=O)=O)=COc2ccc(C)cc12

InChI Key: InChIKey=KQMILVBSRFOWRB-UHFFFAOYSA-L

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 = 50167412   

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 2 (Homo sapiens (Human))	BDBM50167412 (CHEMBL382309 | sulfanilamide derivative ) Show SMILES Cc1ccc2OC=C3CN(CCc4ccc(cc4)S(N)(=O)=O)[Zn]4(Cl)(Cl)(OC3c2c1)OC1C(CN4CCc2ccc(cc2)S(N)(=O)=O)=COc2ccc(C)cc12 |c:51,t:6| Show InChI InChI=1S/2C19H20N2O4S.2ClH.Zn/c2*1-13-2-7-18-17(10-13)19(22)15(12-25-18)11-21-9-8-14-3-5-16(6-4-14)26(20,23)24;;;/h2*2-7,10,12,19H,8-9,11H2,1H3,(H2,20,23,24);2*1H;/q2*-2;;;+6/p-2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ospedale San Lazzaro Curated by ChEMBL					Assay Description Inhibition constant against human carbonic anhydrase II				Bioorg Med Chem Lett 15: 3096-101 (2005) Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50167412 (CHEMBL382309 | sulfanilamide derivative ) Show SMILES Cc1ccc2OC=C3CN(CCc4ccc(cc4)S(N)(=O)=O)[Zn]4(Cl)(Cl)(OC3c2c1)OC1C(CN4CCc2ccc(cc2)S(N)(=O)=O)=COc2ccc(C)cc12 |c:51,t:6| Show InChI InChI=1S/2C19H20N2O4S.2ClH.Zn/c2*1-13-2-7-18-17(10-13)19(22)15(12-25-18)11-21-9-8-14-3-5-16(6-4-14)26(20,23)24;;;/h2*2-7,10,12,19H,8-9,11H2,1H3,(H2,20,23,24);2*1H;/q2*-2;;;+6/p-2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ospedale San Lazzaro Curated by ChEMBL					Assay Description Inhibition constant against human carbonic anhydrase IX				Bioorg Med Chem Lett 15: 3096-101 (2005) Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50167412 (CHEMBL382309 | sulfanilamide derivative ) Show SMILES Cc1ccc2OC=C3CN(CCc4ccc(cc4)S(N)(=O)=O)[Zn]4(Cl)(Cl)(OC3c2c1)OC1C(CN4CCc2ccc(cc2)S(N)(=O)=O)=COc2ccc(C)cc12 |c:51,t:6| Show InChI InChI=1S/2C19H20N2O4S.2ClH.Zn/c2*1-13-2-7-18-17(10-13)19(22)15(12-25-18)11-21-9-8-14-3-5-16(6-4-14)26(20,23)24;;;/h2*2-7,10,12,19H,8-9,11H2,1H3,(H2,20,23,24);2*1H;/q2*-2;;;+6/p-2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ospedale San Lazzaro Curated by ChEMBL					Assay Description Inhibition constant against human carbonic anhydrase I				Bioorg Med Chem Lett 15: 3096-101 (2005) Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50167412 (CHEMBL382309 | sulfanilamide derivative ) Show SMILES Cc1ccc2OC=C3CN(CCc4ccc(cc4)S(N)(=O)=O)[Zn]4(Cl)(Cl)(OC3c2c1)OC1C(CN4CCc2ccc(cc2)S(N)(=O)=O)=COc2ccc(C)cc12 |c:51,t:6| Show InChI InChI=1S/2C19H20N2O4S.2ClH.Zn/c2*1-13-2-7-18-17(10-13)19(22)15(12-25-18)11-21-9-8-14-3-5-16(6-4-14)26(20,23)24;;;/h2*2-7,10,12,19H,8-9,11H2,1H3,(H2,20,23,24);2*1H;/q2*-2;;;+6/p-2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ospedale San Lazzaro Curated by ChEMBL					Assay Description Inhibition constant against human carbonic anhydrase XII				Bioorg Med Chem Lett 15: 3096-101 (2005) Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ
					More data for this Ligand-Target Pair