BDBM80455 2-({[5-({2-[(2-chlorophenyl)amino]-2-oxoethyl}thio)-1,3,4-thiadiazol-2-yl]amino}carbonyl)benzoic acid::2-[[5-[2-(2-chloroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]benzoic acid::2-[[5-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]benzoic acid::2-[[5-[[2-(2-chloroanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]carbamoyl]benzoic acid::2-[[[5-[[2-(2-chloroanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]benzoic acid::MLS000690573::SMR000298831::cid_2291549

SMILES OC(=O)c1ccccc1C(=O)Nc1nnc(SCC(=O)Nc2ccccc2Cl)s1

InChI Key InChIKey=AYOYWTKHJZTGNS-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 80455   

TargetDNA dC->dU-editing enzyme APOBEC-3G(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80455(2-[[[5-[[2-(2-chloroanilino)-2-oxoethyl]thio]-1,3,...)
Affinity DataIC50: 9.42E+3nMT: 2°CAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetDNA dC->dU-editing enzyme APOBEC-3A(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80455(2-[[[5-[[2-(2-chloroanilino)-2-oxoethyl]thio]-1,3,...)
Affinity DataIC50: 1.40E+4nMT: 2°CAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay