BDBM68186 2-({[5-[4-(tert-butyl)phenyl]-2-(methoxycarbonyl)-3-thienyl]amino}carbonyl)benzoic acid::2-[[5-(4-tert-butylphenyl)-2-carbomethoxy-3-thienyl]carbamoyl]benzoic acid::2-[[5-(4-tert-butylphenyl)-2-methoxycarbonyl-thiophen-3-yl]carbamoyl]benzoic acid::2-[[5-(4-tert-butylphenyl)-2-methoxycarbonylthiophen-3-yl]carbamoyl]benzoic acid::2-[[[5-(4-tert-butylphenyl)-2-methoxycarbonyl-3-thiophenyl]amino]-oxomethyl]benzoic acid::MLS000850080::SMR000456098::cid_2810296

SMILES COC(=O)c1sc(cc1NC(=O)c1ccccc1C(O)=O)-c1ccc(cc1)C(C)(C)C

InChI Key InChIKey=DIPNBHWEKWQSCY-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 68186   

TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM68186(SMR000456098 | 2-({[5-[4-(tert-butyl)phenyl]-2-(me...)
Affinity DataIC50: 5.94E+3nMAssay Description:Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay
TargetDNA damage-inducible transcript 3 protein(Mouse)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM68186(SMR000456098 | 2-({[5-[4-(tert-butyl)phenyl]-2-(me...)
Affinity DataIC50: 1.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/12/2011
Entry Details
PCBioAssay
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM68186(SMR000456098 | 2-({[5-[4-(tert-butyl)phenyl]-2-(me...)
Affinity DataIC50: 1.50E+3nMAssay Description:Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2011
Entry Details
PCBioAssay
TargetDNA damage-inducible transcript 3 protein(Mouse)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM68186(SMR000456098 | 2-({[5-[4-(tert-butyl)phenyl]-2-(me...)
Affinity DataIC50: 1.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetX-box-binding protein 1(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM68186(SMR000456098 | 2-({[5-[4-(tert-butyl)phenyl]-2-(me...)
Affinity DataIC50: 1.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay