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19 similar compounds to monomer 79800

Compile data set for download or QSAR
Wt: 277.3
BDBM30770
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Wt: 263.2
BDBM44681
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Wt: 275.3
BDBM50011739
Wt: 233.6
BDBM50011743
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Wt: 250.2
BDBM50011792
Wt: 325.3
BDBM50011794
Wt: 291.3
BDBM50011748
Wt: 275.3
BDBM50011769
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Wt: 277.2
BDBM50011773
Wt: 290.3
BDBM50011782
Wt: 249.2
BDBM50011791
Wt: 263.2
BDBM50011793
Wt: 311.3
BDBM50011795
Wt: 250.2
BDBM50011733
Wt: 233.6
BDBM50011744
Displayed 1 to 15 (of 19 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 30770,44681,50011739,50011743,50011792,50011794,50011748,50011769,50011773,50011782,50011791,50011793,50011795,50011733,50011744   
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
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM30770
PNG
(2-(1-naphthalenyl)-5-(propylamino)-4-oxazolecarbon...)
Show SMILES CCCNc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C17H15N3O/c1-2-10-19-17-15(11-18)20-16(21-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,19H,2,10H2,1H3
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n/an/an/an/a 3.05E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q21N7ZG0
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011795
PNG
(CHEMBL3262922)
Show SMILES N#Cc1nc(oc1Nc1ccccc1)-c1cccc2ccccc12
Show InChI InChI=1S/C20H13N3O/c21-13-18-20(22-15-9-2-1-3-10-15)24-19(23-18)17-12-6-8-14-7-4-5-11-16(14)17/h1-12,22H
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n/an/a>3.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011733
PNG
(CHEMBL3262906)
Show SMILES CNc1oc(nc1C#N)-c1ccc2cnccc2c1
Show InChI InChI=1S/C14H10N4O/c1-16-14-12(7-15)18-13(19-14)10-2-3-11-8-17-5-4-9(11)6-10/h2-6,8,16H,1H3
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n/an/a 730n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011739
PNG
(CHEMBL3262912)
Show SMILES CNc1oc(nc1C#N)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C17H13N3O/c1-19-17-15(11-18)20-16(21-17)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-10,19H,1H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011743
PNG
(CHEMBL1547372)
Show SMILES CNc1oc(nc1C#N)-c1ccc(Cl)cc1
Show InChI InChI=1S/C11H8ClN3O/c1-14-11-9(6-13)15-10(16-11)7-2-4-8(12)5-3-7/h2-5,14H,1H3
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n/an/a 2.50E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011744
PNG
(CHEMBL3262916)
Show SMILES CNc1oc(nc1C#N)-c1cccc(Cl)c1
Show InChI InChI=1S/C11H8ClN3O/c1-14-11-9(6-13)15-10(16-11)7-3-2-4-8(12)5-7/h2-5,14H,1H3
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n/an/a 6.30E+3n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM44681
PNG
(5-(ethylamino)-2-(1-naphthalenyl)-4-oxazolecarboni...)
Show SMILES CCNc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C16H13N3O/c1-2-18-16-14(10-17)19-15(20-16)13-9-5-7-11-6-3-4-8-12(11)13/h3-9,18H,2H2,1H3
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n/an/a 120n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM30770
PNG
(2-(1-naphthalenyl)-5-(propylamino)-4-oxazolecarbon...)
Show SMILES CCCNc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C17H15N3O/c1-2-10-19-17-15(11-18)20-16(21-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,19H,2,10H2,1H3
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n/an/a 100n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011748
PNG
(CHEMBL3262919)
Show SMILES CCCCNc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C18H17N3O/c1-2-3-11-20-18-16(12-19)21-17(22-18)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,20H,2-3,11H2,1H3
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n/an/a 120n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011769
PNG
(CHEMBL1588672)
Show SMILES C=CCNc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C17H13N3O/c1-2-10-19-17-15(11-18)20-16(21-17)14-9-5-7-12-6-3-4-8-13(12)14/h2-9,19H,1,10H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011773
PNG
(CHEMBL1520057)
Show SMILES CC(=O)Nc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C16H11N3O2/c1-10(20)18-16-14(9-17)19-15(21-16)13-8-4-6-11-5-2-3-7-12(11)13/h2-8H,1H3,(H,18,20)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011782
PNG
(CHEMBL3262924)
Show SMILES N#Cc1nc(oc1NC1CNC1)-c1cccc2ccccc12
Show InChI InChI=1S/C17H14N4O/c18-8-15-17(20-12-9-19-10-12)22-16(21-15)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,19-20H,9-10H2
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n/an/a>4.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011791
PNG
(CHEMBL3262903)
Show SMILES CNc1oc(nc1C#N)-c1ccc2ccccc2c1
Show InChI InChI=1S/C15H11N3O/c1-17-15-13(9-16)18-14(19-15)12-7-6-10-4-2-3-5-11(10)8-12/h2-8,17H,1H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011792
PNG
(CHEMBL3262904)
Show SMILES CNc1oc(nc1C#N)-c1cccc2cnccc12
Show InChI InChI=1S/C14H10N4O/c1-16-14-12(7-15)18-13(19-14)11-4-2-3-9-8-17-6-5-10(9)11/h2-6,8,16H,1H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011793
PNG
(CHEMBL3186736)
Show SMILES CN(C)c1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C16H13N3O/c1-19(2)16-14(10-17)18-15(20-16)13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,1-2H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50011794
PNG
(CHEMBL3262921)
Show SMILES N#Cc1nc(oc1NCc1ccccc1)-c1cccc2ccccc12
Show InChI InChI=1S/C21H15N3O/c22-13-19-21(23-14-15-7-2-1-3-8-15)25-20(24-19)18-12-6-10-16-9-4-5-11-17(16)18/h1-12,23H,14H2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal His6-tagged human reticulocyte 12/15-lipoxygenase using arachidonic acid as substrate by UV-vis spectrometric an...


J Med Chem 57: 4035-48 (2014)


Article DOI: 10.1021/jm401915r
BindingDB Entry DOI: 10.7270/Q26T0P58
More data for this
Ligand-Target Pair
Multidrug resistance protein 1/Multidrug resistance associated protein 1


(Homo sapiens (Human))
BDBM44681
PNG
(5-(ethylamino)-2-(1-naphthalenyl)-4-oxazolecarboni...)
Show SMILES CCNc1oc(nc1C#N)-c1cccc2ccccc12
Show InChI InChI=1S/C16H13N3O/c1-2-18-16-14(10-17)19-15(20-16)13-9-5-7-11-6-3-4-8-12(11)13/h3-9,18H,2H2,1H3
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n/an/an/an/a 3.68E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q25719FH
More data for this
Ligand-Target Pair