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Compile Data Set for Download or QSAR

Found 246 hits Enz. Inhib. hit(s) with Target = 'Regulator of G-protein signaling 16'   
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
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM46590
PNG
(4-[2-[(E)-(2,3-dihydroxy-4-oxocyclohexa-2,5-dien-1...)
Show SMILES NS(=O)(=O)c1ccc(N=[NH+]Cc2ccc([O-])c(O)c2O)c(c1)[N+]([O-])=O |w:8.7|
Show InChI InChI=1S/C13H12N4O7S/c14-25(23,24)8-2-3-9(10(5-8)17(21)22)16-15-6-7-1-4-11(18)13(20)12(7)19/h1-5,18-20H,6H2,(H2,14,23,24)
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20n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM38361
PNG
(2-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-benzothiaz...)
Show SMILES O=c1n(sc2ccccc12)-c1ccc(cc1)S(=O)(=O)N1CCCC1
Show InChI InChI=1S/C17H16N2O3S2/c20-17-15-5-1-2-6-16(15)23-19(17)13-7-9-14(10-8-13)24(21,22)18-11-3-4-12-18/h1-2,5-10H,3-4,11-12H2
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20n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM32274
PNG
(2,5-bis(chloranyl)-3-(4-methylpiperazin-1-yl)-6-(2...)
Show SMILES CN1CCN(CC1)C1=C(Cl)C(=O)C(c2cnc(s2)N2CCCCC2)=C(Cl)C1=O |c:8,t:26|
Show InChI InChI=1S/C19H22Cl2N4O2S/c1-23-7-9-24(10-8-23)16-15(21)17(26)13(14(20)18(16)27)12-11-22-19(28-12)25-5-3-2-4-6-25/h11H,2-10H2,1H3
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20n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47719
PNG
((4-chlorodithiazol-5-ylidene)-(4-chloro-2-methyl-p...)
Show SMILES Cc1cc(Cl)ccc1\N=c1\ssnc1Cl
Show InChI InChI=1S/C9H6Cl2N2S2/c1-5-4-6(10)2-3-7(5)12-9-8(11)13-15-14-9/h2-4H,1H3/b12-9+
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40n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM46608
PNG
((4E)-5-methyl-4-[(3-nitroanilino)methylene]-2-phen...)
Show SMILES Cc1[n-]n(-c2ccccc2)c(=S)c1\C=[NH+]\c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C17H14N4O2S/c1-12-16(11-18-13-6-5-9-15(10-13)21(22)23)17(24)20(19-12)14-7-3-2-4-8-14/h2-11H,1H3,(H,18,19,24)
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40n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM34524
PNG
(2-[2-keto-2-[3-methyl-4-(m-tolyl)piperazino]ethyl]...)
Show SMILES CC1CN(CCN1c1cccc(C)c1)C(=O)Cn1sc2nc(C)cc(C)c2c1=O
Show InChI InChI=1S/C22H26N4O2S/c1-14-6-5-7-18(10-14)25-9-8-24(12-17(25)4)19(27)13-26-22(28)20-15(2)11-16(3)23-21(20)29-26/h5-7,10-11,17H,8-9,12-13H2,1-4H3
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90n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM40728
PNG
(2-[2-oxidanylidene-2-[2-[(Z)-(3-oxidanyl-4-oxidany...)
Show SMILES Oc1ccc(C=NNC(=O)COc2ccccc2C(=O)NN=Cc2ccc(O)c(O)c2)cc1O |w:21.21,6.6|
Show InChI InChI=1S/C23H20N4O7/c28-17-7-5-14(9-19(17)30)11-24-26-22(32)13-34-21-4-2-1-3-16(21)23(33)27-25-12-15-6-8-18(29)20(31)10-15/h1-12,28-31H,13H2,(H,26,32)(H,27,33)
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90n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM43363
PNG
(2,5-bis(chloranyl)-3-piperidin-1-yl-6-(2-piperidin...)
Show SMILES ClC1=C(N2CCCCC2)C(=O)C(Cl)=C(c2cnc(s2)N2CCCCC2)C1=O |c:1,t:13|
Show InChI InChI=1S/C19H21Cl2N3O2S/c20-14-13(12-11-22-19(27-12)24-9-5-2-6-10-24)17(25)15(21)16(18(14)26)23-7-3-1-4-8-23/h11H,1-10H2
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100n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47815
PNG
(2-(4-Methoxy-phenyl)-[1,4]benzoquinone | 2-(4-meth...)
Show SMILES COc1ccc(cc1)C1=CC(=O)C=CC1=O |c:13,t:9|
Show InChI InChI=1S/C13H10O3/c1-16-11-5-2-9(3-6-11)12-8-10(14)4-7-13(12)15/h2-8H,1H3
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120n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47735
PNG
(3-chloranyl-N-(3,3-dimethylbutan-2-yl)-6-nitro-1-b...)
Show SMILES CC(NC(=O)c1sc2cc(ccc2c1Cl)[N+]([O-])=O)C(C)(C)C
Show InChI InChI=1S/C15H17ClN2O3S/c1-8(15(2,3)4)17-14(19)13-12(16)10-6-5-9(18(20)21)7-11(10)22-13/h5-8H,1-4H3,(H,17,19)
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170n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM33097
PNG
(3-[[7-(1,3-benzothiazol-2-ylsulfanyl)-4-nitro-2,1,...)
Show SMILES CC(=O)OCCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O
Show InChI InChI=1S/C18H15N5O5S2/c1-10(24)27-8-4-7-19-12-9-14(15-16(22-28-21-15)17(12)23(25)26)30-18-20-11-5-2-3-6-13(11)29-18/h2-3,5-6,9,19H,4,7-8H2,1H3
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220n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
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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270n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47764
PNG
((4E)-5-methyl-4-[[3-[[(Z)-(3-methyl-1-phenyl-5-sul...)
Show SMILES Cc1[nH]n(-c2ccccc2)c(=S)c1C=NCCCN=Cc1c(C)[nH]n(-c2ccccc2)c1=S |w:14.16,18.19|
Show InChI InChI=1S/C25H26N6S2/c1-18-22(24(32)30(28-18)20-10-5-3-6-11-20)16-26-14-9-15-27-17-23-19(2)29-31(25(23)33)21-12-7-4-8-13-21/h3-8,10-13,16-17,28-29H,9,14-15H2,1-2H3
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330n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM34702
PNG
((4E)-2,3-dihydroxy-4-[[(4-methyl-2-methylimino-1,3...)
Show SMILES CN=c1scc(C)n1N=Cc1ccc(O)c(O)c1O |w:8.8,1.0|
Show InChI InChI=1S/C12H13N3O3S/c1-7-6-19-12(13-2)15(7)14-5-8-3-4-9(16)11(18)10(8)17/h3-6,16-18H,1-2H3
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410n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM33145
PNG
(3-[[[(E)-(2,3-dihydroxy-4-keto-cyclohexa-2,5-dien-...)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)NN=Cc1ccc(O)c(O)c1O |w:17.17|
Show InChI InChI=1S/C18H21N3O6S/c1-3-21(4-2)28(26,27)14-7-5-6-12(10-14)18(25)20-19-11-13-8-9-15(22)17(24)16(13)23/h5-11,22-24H,3-4H2,1-2H3,(H,20,25)
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480n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM34435
PNG
(4-cyano-3-methyl-5-[[1-oxo-2-[[5-(phenylmethyl)-1,...)
Show SMILES CCOC(=O)c1sc(NC(=O)CSc2nnc(Cc3ccccc3)o2)c(C#N)c1C
Show InChI InChI=1S/C20H18N4O4S2/c1-3-27-19(26)17-12(2)14(10-21)18(30-17)22-15(25)11-29-20-24-23-16(28-20)9-13-7-5-4-6-8-13/h4-8H,3,9,11H2,1-2H3,(H,22,25)
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580n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM34972
PNG
(MLS000759648 | N''-[(E)-(2,3-dihydroxy-4-oxo-1-cyc...)
Show SMILES Oc1ccc(C=NNC(=O)Cc2csc(n2)N2CCOCC2)c(O)c1O |w:6.6|
Show InChI InChI=1S/C16H18N4O5S/c21-12-2-1-10(14(23)15(12)24)8-17-19-13(22)7-11-9-26-16(18-11)20-3-5-25-6-4-20/h1-2,8-9,21,23-24H,3-7H2,(H,19,22)
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670n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47747
PNG
(4-[(E)-[3-[3-(diethylsulfamoyl)phenyl]-5-thioxo-1H...)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(c1)-c1n[nH]c(=S)n1N=Cc1ccc(cc1)C(=O)OC |w:20.21|
Show InChI InChI=1S/C21H23N5O4S2/c1-4-25(5-2)32(28,29)18-8-6-7-17(13-18)19-23-24-21(31)26(19)22-14-15-9-11-16(12-10-15)20(27)30-3/h6-14H,4-5H2,1-3H3,(H,24,31)
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760n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM33090
PNG
((4E)-4-[[(2-ethylimino-4-methyl-1,3-thiazol-3-yl)a...)
Show SMILES CCN=c1scc(C)n1N=Cc1ccc(O)c(O)c1O |w:9.9,2.1|
Show InChI InChI=1S/C13H15N3O3S/c1-3-14-13-16(8(2)7-20-13)15-6-9-4-5-10(17)12(19)11(9)18/h4-7,17-19H,3H2,1-2H3
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850n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47696
PNG
(4-[(3-carbamoyl-4,5-dimethyl-2-thienyl)amino]-4-ke...)
Show SMILES COC(=O)CCC(=O)Nc1sc(C)c(C)c1C(N)=O
Show InChI InChI=1S/C12H16N2O4S/c1-6-7(2)19-12(10(6)11(13)17)14-8(15)4-5-9(16)18-3/h4-5H2,1-3H3,(H2,13,17)(H,14,15)
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1.14E+3n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM62216
PNG
(2-(4,6-dimethylisothiazolo[5,4-b]pyridin-3-yl)oxy-...)
Show SMILES CC1CN(CCN1c1cccc(C)c1)C(=O)COc1nsc2nc(C)cc(C)c12
Show InChI InChI=1S/C22H26N4O2S/c1-14-6-5-7-18(10-14)26-9-8-25(12-17(26)4)19(27)13-28-21-20-15(2)11-16(3)23-22(20)29-24-21/h5-7,10-11,17H,8-9,12-13H2,1-4H3
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1.16E+3n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47770
PNG
(4-[5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene...)
Show SMILES [#6]C1([#6])[#8]-[#6](=O)\[#6](=[#6]/c2ccc(o2)-c2ccc(cc2)S([#7])(=O)=O)-[#6](=O)-[#8]1
Show InChI InChI=1S/C17H15NO7S/c1-17(2)24-15(19)13(16(20)25-17)9-11-5-8-14(23-11)10-3-6-12(7-4-10)26(18,21)22/h3-9H,1-2H3,(H2,18,21,22)
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2.84E+3n/an/an/an/an/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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47798
PNG
(4-chloranyl-6-(4,6-dimethylpyrimidin-2-yl)sulfanyl...)
Show SMILES CNc1nc(Cl)nc(Sc2nc(C)cc(C)n2)n1
Show InChI InChI=1S/C10H11ClN6S/c1-5-4-6(2)14-9(13-5)18-10-16-7(11)15-8(12-3)17-10/h4H,1-3H3,(H,12,15,16,17)
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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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47734
PNG
(MLS000553854 | N-[(4-methylphenyl)-(5-nitro-8-oxid...)
Show SMILES CCC(=O)NC(c1ccc(C)cc1)c1cc([N+]([O-])=O)c2cccnc2c1O
Show InChI InChI=1S/C20H19N3O4/c1-3-17(24)22-18(13-8-6-12(2)7-9-13)15-11-16(23(26)27)14-5-4-10-21-19(14)20(15)25/h4-11,18,25H,3H2,1-2H3,(H,22,24)
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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/Q2QR4VJR
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM50384774
PNG
(CHEMBL1917204 | US20230414581, Compound 6)
Show SMILES Cc1ccc(cc1)-n1sc(=O)n(Cc2ccc(F)cc2)c1=O
Show InChI InChI=1S/C16H13FN2O2S/c1-11-2-8-14(9-3-11)19-15(20)18(16(21)22-19)10-12-4-6-13(17)7-5-12/h2-9H,10H2,1H3
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US Patent
n/an/a 3.50E+3n/an/an/an/an/an/a



The Regents of The University of Michigan; The University of Bath

US Patent


Assay Description
FCPIA Characterization of RGS Inhibitory Activity: CCG-50014 (FIG. 1) was originally identified as a potential inhibitor of RGS8 and RGS16 in a polyp...


US Patent US8865750 (2014)


BindingDB Entry DOI: 10.7270/Q20000TC
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47761
PNG
(2-(5-nitropyridin-2-yl)sulfanylpyridin-3-amine | 2...)
Show SMILES Nc1cccnc1Sc1ccc(cn1)[N+]([O-])=O
Show InChI InChI=1S/C10H8N4O2S/c11-8-2-1-5-12-10(8)17-9-4-3-7(6-13-9)14(15)16/h1-6H,11H2
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47762
PNG
(4-butyl-3-(5-isopropyl-3-thienyl)-1H-1,2,4-triazol...)
Show SMILES CCCCn1c(n[nH]c1=S)-c1csc(c1)C(C)C
Show InChI InChI=1S/C13H19N3S2/c1-4-5-6-16-12(14-15-13(16)17)10-7-11(9(2)3)18-8-10/h7-9H,4-6H2,1-3H3,(H,15,17)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47763
PNG
(1-(4-chloranyl-2,5-dimethoxy-phenyl)sulfonyl-2-eth...)
Show SMILES CCc1nccn1S(=O)(=O)c1cc(OC)c(Cl)cc1OC
Show InChI InChI=1S/C13H15ClN2O4S/c1-4-13-15-5-6-16(13)21(17,18)12-8-10(19-2)9(14)7-11(12)20-3/h5-8H,4H2,1-3H3
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47764
PNG
((4E)-5-methyl-4-[[3-[[(Z)-(3-methyl-1-phenyl-5-sul...)
Show SMILES Cc1[nH]n(-c2ccccc2)c(=S)c1C=NCCCN=Cc1c(C)[nH]n(-c2ccccc2)c1=S |w:14.16,18.19|
Show InChI InChI=1S/C25H26N6S2/c1-18-22(24(32)30(28-18)20-10-5-3-6-11-20)16-26-14-9-15-27-17-23-19(2)29-31(25(23)33)21-12-7-4-8-13-21/h3-8,10-13,16-17,28-29H,9,14-15H2,1-2H3
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n/an/an/an/a 8.79E+3n/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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47765
PNG
(MLS000677175 | N-(dibenzylcarbamothioyl)-2-methylp...)
Show SMILES CC(C)C(=O)NC(=S)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C19H22N2OS/c1-15(2)18(22)20-19(23)21(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,20,22,23)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47766
PNG
(MLS000676949 | N-[(1,5-dimethyl-3-oxidanylidene-2-...)
Show SMILES Cc1c(NC(=S)NC(=O)C2CCCCC2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C19H24N4O2S/c1-13-16(18(25)23(22(13)2)15-11-7-4-8-12-15)20-19(26)21-17(24)14-9-5-3-6-10-14/h4,7-8,11-12,14H,3,5-6,9-10H2,1-2H3,(H2,20,21,24,26)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47767
PNG
(3-(phenoxymethyl)-4-(phenylmethyl)-1H-1,2,4-triazo...)
Show SMILES S=c1[nH]nc(COc2ccccc2)n1Cc1ccccc1
Show InChI InChI=1S/C16H15N3OS/c21-16-18-17-15(12-20-14-9-5-2-6-10-14)19(16)11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,18,21)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47768
PNG
(MLS000681208 | N-[2-(3,5-dimethylphenoxy)ethyl]-3-...)
Show SMILES COc1cccc(c1)C(=O)NCCOc1cc(C)cc(C)c1
Show InChI InChI=1S/C18H21NO3/c1-13-9-14(2)11-17(10-13)22-8-7-19-18(20)15-5-4-6-16(12-15)21-3/h4-6,9-12H,7-8H2,1-3H3,(H,19,20)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47769
PNG
(2-[4-(2,6-dimethyl-4-morpholinyl)butoxy]benzoic ac...)
Show SMILES COC(=O)c1ccccc1OCCCCN1CC(C)OC(C)C1
Show InChI InChI=1S/C18H27NO4/c1-14-12-19(13-15(2)23-14)10-6-7-11-22-17-9-5-4-8-16(17)18(20)21-3/h4-5,8-9,14-15H,6-7,10-13H2,1-3H3
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47770
PNG
(4-[5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene...)
Show SMILES [#6]C1([#6])[#8]-[#6](=O)\[#6](=[#6]/c2ccc(o2)-c2ccc(cc2)S([#7])(=O)=O)-[#6](=O)-[#8]1
Show InChI InChI=1S/C17H15NO7S/c1-17(2)24-15(19)13(16(20)25-17)9-11-5-8-14(23-11)10-3-6-12(7-4-10)26(18,21)22/h3-9H,1-2H3,(H2,18,21,22)
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n/an/an/an/a 1.19E+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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM34849
PNG
(6-fluoranyl-2-(2-methylphenyl)-1,2-benzothiazol-3-...)
Show SMILES Cc1ccccc1-n1sc2cc(F)ccc2c1=O
Show InChI InChI=1S/C14H10FNOS/c1-9-4-2-3-5-12(9)16-14(17)11-7-6-10(15)8-13(11)18-16/h2-8H,1H3
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n/an/an/an/a 1.60E+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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47771
PNG
(2-[(2-methylsulfanylphenyl)carbamoyl]bicyclo[2.2.1...)
Show SMILES [H]C12CCC([H])(C1)C(C2C(O)=O)C(=O)Nc1ccccc1SC |TLB:12:7:6:3.2,THB:9:8:6:3.2|
Show InChI InChI=1S/C16H19NO3S/c1-21-12-5-3-2-4-11(12)17-15(18)13-9-6-7-10(8-9)14(13)16(19)20/h2-5,9-10,13-14H,6-8H2,1H3,(H,17,18)(H,19,20)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47772
PNG
(4-(4-bromophenyl)-3-[1-(4-chlorophenyl)-5-methyl-1...)
Show SMILES Cc1c(nnn1-c1ccc(Cl)cc1)-c1n[nH]c(=S)n1-c1ccc(Br)cc1
Show InChI InChI=1S/C17H12BrClN6S/c1-10-15(20-23-25(10)14-8-4-12(19)5-9-14)16-21-22-17(26)24(16)13-6-2-11(18)3-7-13/h2-9H,1H3,(H,22,26)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47773
PNG
(MLS000693809 | N-cycloheptyl-4-ethoxy-benzenesulfo...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)NC1CCCCCC1
Show InChI InChI=1S/C15H23NO3S/c1-2-19-14-9-11-15(12-10-14)20(17,18)16-13-7-5-3-4-6-8-13/h9-13,16H,2-8H2,1H3
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47774
PNG
(MLS000621789 | N-(3-chloranyl-4-methyl-phenyl)-2-[...)
Show SMILES Cc1ccc(NC(=O)CSc2nc3ccccc3c(=O)n2CCCN2CCCCC2)cc1Cl
Show InChI InChI=1S/C25H29ClN4O2S/c1-18-10-11-19(16-21(18)26)27-23(31)17-33-25-28-22-9-4-3-8-20(22)24(32)30(25)15-7-14-29-12-5-2-6-13-29/h3-4,8-11,16H,2,5-7,12-15,17H2,1H3,(H,27,31)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47775
PNG
(MLS000621762 | N-(2-chlorophenyl)-2-({3-[3-(4-meth...)
Show SMILES CC1CCN(CCCn2c(SCC(=O)Nc3ccccc3Cl)nc3ccccc3c2=O)CC1
Show InChI InChI=1S/C25H29ClN4O2S/c1-18-11-15-29(16-12-18)13-6-14-30-24(32)19-7-2-4-9-21(19)28-25(30)33-17-23(31)27-22-10-5-3-8-20(22)26/h2-5,7-10,18H,6,11-17H2,1H3,(H,27,31)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
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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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47777
PNG
(MLS000375249 | N-[1-[1-[2-[4-(diethylamino)anilino...)
Show SMILES CCN(CC)c1ccc(NC(=O)Cn2c(nc3ccccc23)C(C)NC(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C29H33N5O2/c1-5-33(6-2)24-17-15-23(16-18-24)31-27(35)19-34-26-10-8-7-9-25(26)32-28(34)21(4)30-29(36)22-13-11-20(3)12-14-22/h7-18,21H,5-6,19H2,1-4H3,(H,30,36)(H,31,35)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47778
PNG
(1-(2-methoxy-5-methyl-phenyl)-3-(3-methoxyphenyl)u...)
Show SMILES COc1cccc(NC(=O)Nc2cc(C)ccc2OC)c1
Show InChI InChI=1S/C16H18N2O3/c1-11-7-8-15(21-3)14(9-11)18-16(19)17-12-5-4-6-13(10-12)20-2/h4-10H,1-3H3,(H2,17,18,19)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47779
PNG
(2-furanyl-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-p...)
Show SMILES [O-][N+](=O)c1ccc(cc1N1CCOCC1)N1CCN(CC1)C(=O)c1ccco1
Show InChI InChI=1S/C19H22N4O5/c24-19(18-2-1-11-28-18)22-7-5-20(6-8-22)15-3-4-16(23(25)26)17(14-15)21-9-12-27-13-10-21/h1-4,11,14H,5-10,12-13H2
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47780
PNG
(2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[2-(phe...)
Show SMILES Cc1cc(C)cc(c1)N(CC(=O)NCCSCc1ccccc1)S(C)(=O)=O
Show InChI InChI=1S/C20H26N2O3S2/c1-16-11-17(2)13-19(12-16)22(27(3,24)25)14-20(23)21-9-10-26-15-18-7-5-4-6-8-18/h4-8,11-13H,9-10,14-15H2,1-3H3,(H,21,23)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47781
PNG
(5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-ox...)
Show SMILES OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H27NO4/c25-21(12-7-13-22(26)27)24-16-14-20(15-17-24)23(28,18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,28H,7,12-17H2,(H,26,27)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47782
PNG
(4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-t...)
Show SMILES COc1ccccc1-n1c(n[nH]c1=S)-c1ccccc1 |(3.08,-1.57,;4.41,-.8,;5.75,-1.57,;5.75,-3.11,;7.08,-3.88,;8.41,-3.11,;8.41,-1.57,;7.08,-.8,;7.08,.74,;8.33,1.64,;7.85,3.11,;6.31,3.11,;5.84,1.64,;4.37,1.17,;9.79,1.17,;10.11,-.34,;11.58,-.81,;12.72,.22,;12.4,1.72,;10.94,2.2,)|
Show InChI InChI=1S/C15H13N3OS/c1-19-13-10-6-5-9-12(13)18-14(16-17-15(18)20)11-7-3-2-4-8-11/h2-10H,1H3,(H,17,20)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47783
PNG
(4-[(2-chloranyl-6-fluoranyl-phenyl)methylideneamin...)
Show SMILES Fc1cccc(Cl)c1C=Nn1c(n[nH]c1=S)-c1cccnc1 |w:9.10|
Show InChI InChI=1S/C14H9ClFN5S/c15-11-4-1-5-12(16)10(11)8-18-21-13(19-20-14(21)22)9-3-2-6-17-7-9/h1-8H,(H,20,22)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 16


(Homo sapiens (Human))
BDBM47784
PNG
(2-[[(2-acetamido-5-bromo-phenyl)-phenyl-methyl]ami...)
Show SMILES COC(=O)CNC(c1ccccc1)c1cc(Br)ccc1NC(C)=O
Show InChI InChI=1S/C18H19BrN2O3/c1-12(22)21-16-9-8-14(19)10-15(16)18(20-11-17(23)24-2)13-6-4-3-5-7-13/h3-10,18,20H,11H2,1-2H3,(H,21,22)
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2FB51BW
More data for this
Ligand-Target Pair
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