BDBM50088252 3,3,3',3'-tetramethyl-1,1'-spirobi(indan)-4,4',7,7'-tetrabromo-5,5',6,6'-tetrol tetrasulfate::CHEMBL292735

SMILES: CC1(C)CC2(CC(C)(C)c3c2c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c3Br)c2c1c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c2Br

InChI Key: InChIKey=WYOZXPRSNDIGSB-UHFFFAOYSA-J

Data: 4 IC50

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 = 50088252   

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
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1)	BDBM50088252 (3,3,3',3'-tetramethyl-1,1'-spirobi(indan)-4,4',7,7...) Show SMILES CC1(C)CC2(CC(C)(C)c3c2c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c3Br)c2c1c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c2Br Show InChI InChI=1S/C21H20Br4O16S4/c1-19(2)5-21(9-7(19)11(22)15(38-42(26,27)28)17(13(9)24)40-44(32,33)34)6-20(3,4)8-10(21)14(25)18(41-45(35,36)37)16(12(8)23)39-43(29,30)31/h5-6H2,1-4H3,(H,26,27,28)(H,29,30,31)(H,32,33,34)(H,35,36,37)/p-4	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Tested in vitro against strand -transfer (ST) activity in the presence of Mg2+ as the cationic cofactor				J Med Chem 43: 2031-9 (2000) BindingDB Entry DOI: 10.7270/Q2B56J0B
					More data for this Ligand-Target Pair
Topoiomerase 1B (Molluscum contagiosum virus subtype 1)	BDBM50088252 (3,3,3',3'-tetramethyl-1,1'-spirobi(indan)-4,4',7,7...) Show SMILES CC1(C)CC2(CC(C)(C)c3c2c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c3Br)c2c1c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c2Br Show InChI InChI=1S/C21H20Br4O16S4/c1-19(2)5-21(9-7(19)11(22)15(38-42(26,27)28)17(13(9)24)40-44(32,33)34)6-20(3,4)8-10(21)14(25)18(41-45(35,36)37)16(12(8)23)39-43(29,30)31/h5-6H2,1-4H3,(H,26,27,28)(H,29,30,31)(H,32,33,34)(H,35,36,37)/p-4	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description DNA cleavage and religation activity as inhibition of type 1B topoisomerase of molluscum contagiosum virus (MCV)				J Med Chem 43: 2031-9 (2000) BindingDB Entry DOI: 10.7270/Q2B56J0B
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1)	BDBM50088252 (3,3,3',3'-tetramethyl-1,1'-spirobi(indan)-4,4',7,7...) Show SMILES CC1(C)CC2(CC(C)(C)c3c2c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c3Br)c2c1c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c2Br Show InChI InChI=1S/C21H20Br4O16S4/c1-19(2)5-21(9-7(19)11(22)15(38-42(26,27)28)17(13(9)24)40-44(32,33)34)6-20(3,4)8-10(21)14(25)18(41-45(35,36)37)16(12(8)23)39-43(29,30)31/h5-6H2,1-4H3,(H,26,27,28)(H,29,30,31)(H,32,33,34)(H,35,36,37)/p-4	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of 3'-processing (TC) in the presence of Mn2+ in vitro				J Med Chem 43: 2031-9 (2000) BindingDB Entry DOI: 10.7270/Q2B56J0B
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1)	BDBM50088252 (3,3,3',3'-tetramethyl-1,1'-spirobi(indan)-4,4',7,7...) Show SMILES CC1(C)CC2(CC(C)(C)c3c2c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c3Br)c2c1c(Br)c(OS([O-])(=O)=O)c(OS([O-])(=O)=O)c2Br Show InChI InChI=1S/C21H20Br4O16S4/c1-19(2)5-21(9-7(19)11(22)15(38-42(26,27)28)17(13(9)24)40-44(32,33)34)6-20(3,4)8-10(21)14(25)18(41-45(35,36)37)16(12(8)23)39-43(29,30)31/h5-6H2,1-4H3,(H,26,27,28)(H,29,30,31)(H,32,33,34)(H,35,36,37)/p-4	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of strand -transfer (ST) activity in the presence of Mn2+				J Med Chem 43: 2031-9 (2000) BindingDB Entry DOI: 10.7270/Q2B56J0B
					More data for this Ligand-Target Pair