BDBM61199 4-({4-[(E)-(5-oxo-1-phenyl-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}methyl)benzoic acid::4-[[4-[(E)-(5-keto-1-phenyl-3-propyl-2-pyrazolin-4-ylidene)methyl]phenoxy]methyl]benzoic acid::4-[[4-[(E)-(5-oxidanylidene-1-phenyl-3-propyl-pyrazol-4-ylidene)methyl]phenoxy]methyl]benzoic acid::4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl-4-pyrazolylidene)methyl]phenoxy]methyl]benzoic acid::4-[[4-[(E)-(5-oxo-1-phenyl-3-propylpyrazol-4-ylidene)methyl]phenoxy]methyl]benzoic acid::4-[[4-[(Z)-(5-keto-1-phenyl-3-propyl-2-pyrazolin-4-ylidene)methyl]phenoxy]methyl]benzoic acid::MLS000686360::SMR000313203::cid_16194028

SMILES CCC=c1[nH]n(-c2ccccc2)c(=O)c1=Cc1ccc(OCc2ccc(cc2)C(O)=O)cc1

InChI Key InChIKey=KTZQJIAWKRPMDL-UHFFFAOYSA-N

Data  6 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 61199   

TargetSUMO-conjugating enzyme UBC9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61199(SMR000313203 | 4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl...)
Affinity DataIC50: 9.45E+3nMAssay 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:
6/5/2011
Entry Details
PCBioAssay
TargetSUMO-activating enzyme subunit 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61199(SMR000313203 | 4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl...)
Affinity DataIC50: 3.77E+4nMAssay 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:
7/9/2011
Entry Details
PCBioAssay
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61199(SMR000313203 | 4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl...)
Affinity DataIC50: 1.51E+4nMAssay 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
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61199(SMR000313203 | 4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl...)
Affinity DataIC50: 1.05E+4nMAssay 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
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61199(SMR000313203 | 4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl...)
Affinity DataIC50: 2.01E+4nMAssay 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
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61199(SMR000313203 | 4-[[4-[(E)-(5-oxo-1-phenyl-3-propyl...)
Affinity DataIC50: 1.86E+4nMAssay 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