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PubChem AID 2827

Compile data set for download or QSAR
Found 5 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens)
BDBM67702
PNG
(3-chloranyl-N-(3-imidazol-1-ylpropyl)-6-nitro-1-be...)
Show SMILES [O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)NCCCn1ccnc1
Show InChI InChI=1S/C15H13ClN4O3S/c16-13-11-3-2-10(20(22)23)8-12(11)24-14(13)15(21)18-4-1-6-19-7-5-17-9-19/h2-3,5,7-9H,1,4,6H2,(H,18,21)
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n/an/an/an/a>3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22J699S
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens)
BDBM47776
PNG
(3-chloranyl-N-(3-morpholin-4-ylpropyl)-6-nitro-1-b...)
Show SMILES [O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)NCCCN1CCOCC1
Show InChI InChI=1S/C16H18ClN3O4S/c17-14-12-3-2-11(20(22)23)10-13(12)25-15(14)16(21)18-4-1-5-19-6-8-24-9-7-19/h2-3,10H,1,4-9H2,(H,18,21)
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n/an/an/an/a>3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22J699S
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens)
BDBM67701
PNG
(3-chloranyl-6-methyl-N-(3-morpholin-4-ylpropyl)-1-...)
Show SMILES Cc1ccc2c(Cl)c(sc2c1)C(=O)NCCCN1CCOCC1
Show InChI InChI=1S/C17H21ClN2O2S/c1-12-3-4-13-14(11-12)23-16(15(13)18)17(21)19-5-2-6-20-7-9-22-10-8-20/h3-4,11H,2,5-10H2,1H3,(H,19,21)
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n/an/an/an/a>3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22J699S
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens)
BDBM67699
PNG
((3-chloranyl-6-nitro-1-benzothiophen-2-yl)-piperaz...)
Show SMILES [O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)N1CCNCC1
Show InChI InChI=1S/C13H12ClN3O3S/c14-11-9-2-1-8(17(19)20)7-10(9)21-12(11)13(18)16-5-3-15-4-6-16/h1-2,7,15H,3-6H2
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n/an/an/an/a>3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22J699S
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens)
BDBM67700
PNG
(3-chloranyl-6-nitro-1-benzothiophene-2-carboxamide...)
Show SMILES NC(=O)c1sc2cc(ccc2c1Cl)[N+]([O-])=O
Show InChI InChI=1S/C9H5ClN2O3S/c10-7-5-2-1-4(12(14)15)3-6(5)16-8(7)9(11)13/h1-3H,(H2,11,13)
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n/an/an/an/a>3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH R21NS057014 HTS to identify small molecule regulators of RGS family protein interaction...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22J699S
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%