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BDBM74289 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide::1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide::MLS002180231::N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide::N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-homoveratryl-5-keto-pyrrolidine-3-carboxamide::SMR001269261::cid_25162099

SMILES: COc1ccc(CCN2CC(CC2=O)C(=O)Nc2nnc(Cc3ccccc3)s2)cc1OC

InChI Key: InChIKey=ZSTRSAIDMQEOBV-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 74289   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
LANA


(Human herpesvirus 8)		BDBM74289
PNG
(1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N...)
Show SMILES COc1ccc(CCN2CC(CC2=O)C(=O)Nc2nnc(Cc3ccccc3)s2)cc1OC
Show InChI InChI=1S/C24H26N4O4S/c1-31-19-9-8-17(12-20(19)32-2)10-11-28-15-18(14-22(28)29)23(30)25-24-27-26-21(33-24)13-16-6-4-3-5-7-16/h3-9,12,18H,10-11,13-15H2,1-2H3,(H,25,27,30)
PDB

KEGG

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>7.50E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Primary Collaborators: Kenneth Kaye,Brigham & Womens,Boston MA,kkaye@rics.bwh.harvard.edu,617-525-4256 Chantal Beauchemin,Brigham & Womens,Boston MA,...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2HH6HHN
More data for this
Ligand-Target Pair