BDBM51231 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethylbenzimidazole-5-carboxylic acid::2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1-ethyl-benzimidazole-5-carboxylic acid::2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-1-ethyl-5-benzimidazolecarboxylic acid::2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-1-ethyl-benzimidazole-5-carboxylic acid::MLS000774165::SMR000364979::cid_2123444

SMILES CCn1c(CSc2nnc(N)[nH]2)nc2cc(ccc12)C(O)=O

InChI Key InChIKey=IUAXNJRDRINNMZ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 51231   

TargetGlycoprotein 42(HHV-4)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM51231(2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-...)
Affinity DataIC50:  5.63E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetFibrinogen beta chain [164-491](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM51231(2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-...)
Affinity DataIC50:  8.33E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetFibrinogen beta chain [164-491](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM51231(2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-...)
Affinity DataIC50:  8.92E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay