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BDBM34625 (4-ethoxybenzyl)-(4-pyrrolidinophenyl)amine::(4-ethoxybenzyl)[4-(1-pyrrolidinyl)phenyl]amine::MLS000062337::N-[(4-ethoxyphenyl)methyl]-4-(1-pyrrolidinyl)aniline::N-[(4-ethoxyphenyl)methyl]-4-pyrrolidin-1-yl-aniline::N-[(4-ethoxyphenyl)methyl]-4-pyrrolidin-1-ylaniline::SMR000072932::cid_755971

SMILES: CCOc1ccc(CNc2ccc(cc2)N2CCCC2)cc1

InChI Key: InChIKey=ZGSRIWGMVVTLKB-UHFFFAOYSA-N

Data: 5 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 34625   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM34625
PNG
((4-ethoxybenzyl)-(4-pyrrolidinophenyl)amine | (4-e...)
Show SMILES CCOc1ccc(CNc2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C19H24N2O/c1-2-22-19-11-5-16(6-12-19)15-20-17-7-9-18(10-8-17)21-13-3-4-14-21/h5-12,20H,2-4,13-15H2,1H3
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UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/a7.423



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
The purpose of this assay is to identify non-competititve inhibitors of human PMI. This is accomplished by using a G6PD- NADPH-coupled assay. In the ...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2CF9NFM
More data for this
Ligand-Target Pair
Glucose-6-phosphate 1-dehydrogenase


(Homo sapiens (Human))
BDBM34625
PNG
((4-ethoxybenzyl)-(4-pyrrolidinophenyl)amine | (4-e...)
Show SMILES CCOc1ccc(CNc2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C19H24N2O/c1-2-22-19-11-5-16(6-12-19)15-20-17-7-9-18(10-8-17)21-13-3-4-14-21/h5-12,20H,2-4,13-15H2,1H3
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antibodypedia
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UniChem
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n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V12389
More data for this
Ligand-Target Pair
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM34625
PNG
((4-ethoxybenzyl)-(4-pyrrolidinophenyl)amine | (4-e...)
Show SMILES CCOc1ccc(CNc2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C19H24N2O/c1-2-22-19-11-5-16(6-12-19)15-20-17-7-9-18(10-8-17)21-13-3-4-14-21/h5-12,20H,2-4,13-15H2,1H3
UniProtKB/TrEMBL

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UniChem
PCBioAssay
n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q23T9FQ1
More data for this
Ligand-Target Pair
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM34625
PNG
((4-ethoxybenzyl)-(4-pyrrolidinophenyl)amine | (4-e...)
Show SMILES CCOc1ccc(CNc2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C19H24N2O/c1-2-22-19-11-5-16(6-12-19)15-20-17-7-9-18(10-8-17)21-13-3-4-14-21/h5-12,20H,2-4,13-15H2,1H3
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>8.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q27H1H3W
More data for this
Ligand-Target Pair
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM34625
PNG
((4-ethoxybenzyl)-(4-pyrrolidinophenyl)amine | (4-e...)
Show SMILES CCOc1ccc(CNc2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C19H24N2O/c1-2-22-19-11-5-16(6-12-19)15-20-17-7-9-18(10-8-17)21-13-3-4-14-21/h5-12,20H,2-4,13-15H2,1H3
UniProtKB/TrEMBL

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UniChem
PCBioAssay
n/an/a 2.64E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2ZS2TZG
More data for this
Ligand-Target Pair