BDBM328 (3R,4S,5S,6R)-3,6-Bis(phenoxymethyl)-2,7-bis[3-(2-thienyl)benzyl]-4,5-dihydroxy-1,2,7-thiadiazepine 1,1-Dioxide::(3R,4S,5S,6R)-4,5-dihydroxy-3,6-bis(phenoxymethyl)-2,7-bis({[3-(thiophen-2-yl)phenyl]methyl})-1,2,7-thiadiazepane-1,1-dione::Cyclic Sulfamide deriv. 6

SMILES: O[C@@H]1[C@@H](O)[C@@H](COc2ccccc2)N(Cc2cccc(c2)-c2cccs2)S(=O)(=O)N(Cc2cccc(c2)-c2cccs2)[C@@H]1COc1ccccc1

InChI Key: InChIKey=BFCBBDDJOYSCOW-JFDQHVTASA-N

Data: 1 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 1 hit for monomerid = 328   

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
HIV-1 Protease (Human immunodeficiency virus type 1)	BDBM328 ((3R,4S,5S,6R)-3,6-Bis(phenoxymethyl)-2,7-bis[3-(2-...) Show SMILES O[C@@H]1[C@@H](O)[C@@H](COc2ccccc2)N(Cc2cccc(c2)-c2cccs2)S(=O)(=O)N(Cc2cccc(c2)-c2cccs2)[C@@H]1COc1ccccc1 |r| Show InChI InChI=1S/C40H38N2O6S3/c43-39-35(27-47-33-15-3-1-4-16-33)41(25-29-11-7-13-31(23-29)37-19-9-21-49-37)51(45,46)42(36(40(39)44)28-48-34-17-5-2-6-18-34)26-30-12-8-14-32(24-30)38-20-10-22-50-38/h1-24,35-36,39-40,43-44H,25-28H2/t35-,36-,39+,40+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.20E+3	-7.84	n/a	n/a	n/a	n/a	n/a	5.0	30
Uppsala University					Assay Description A fluorimetric assay was used to determine the effects of the inhibitors on HIV-1 protease. This assay used an internally quenched fluorescent peptid...				J Med Chem 44: 155-69 (2001) Article DOI: 10.1021/jm001024j BindingDB Entry DOI: 10.7270/Q2JM27T6
					More data for this Ligand-Target Pair