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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Regulator of G-protein signaling 8' and Ligand = 'BDBM47747'   
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 8


(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)
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
2.59E+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)

More data for this
Ligand-Target Pair
Regulator of G-protein signaling 8


(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)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
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 (2009)

More data for this
Ligand-Target Pair
Regulator of G-protein signaling 8


(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)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.13E+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 (2010)

More data for this
Ligand-Target Pair