BDBM37302 MLS000087458::N-[1-(4-chlorobenzyl)-5-methyl-1H-pyrazol-3-yl]-7-methoxy-4,5-dihydronaphtho[2,1-d]isoxazole-3-carboxamide::N-[1-(4-chlorobenzyl)-5-methyl-pyrazol-3-yl]-7-methoxy-4,5-dihydrobenz[g]indoxazene-3-carboxamide::N-[1-[(4-chlorophenyl)methyl]-5-methyl-3-pyrazolyl]-7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxamide::N-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]-7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxamide::N-[1-[(4-chlorophenyl)methyl]-5-methylpyrazol-3-yl]-7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxamide::SMR000023681::cid_3242904

SMILES COc1ccc2-c3onc(C(=O)Nc4cc(C)n(Cc5ccc(Cl)cc5)n4)c3CCc2c1

InChI Key InChIKey=RPMGRWSWGYXZOA-UHFFFAOYSA-N

Data  8 IC50  1 EC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 37302   

TargetCathepsin G(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.47E+3nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/12/2011
Entry Details
PCBioAssay
TargetE3 ubiquitin-protein ligase XIAP(Human)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay 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:
7/8/2011
Entry Details
PCBioAssay
TargetPantothenate synthetase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Srmlsc

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetPantothenate synthetase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Srmlsc

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetPantothenate synthetase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Srmlsc

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetPantothenate synthetase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Srmlsc

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetPantothenate synthetase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Srmlsc

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetPantothenate synthetase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Srmlsc

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37302BDBM37302(SMR000023681 | N-[1-[(4-chlorophenyl)methyl]-5-met...)
Affinity DataIC50: 1.00E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay