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BDBM47721 MLS000523066::N-[2-[6-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-3-oxidanylidene-4H-quinoxalin-2-yl]phenyl]ethanamide::N-[2-[6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-3-keto-4H-quinoxalin-2-yl]phenyl]acetamide::N-[2-[6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-3-oxo-4H-quinoxalin-2-yl]phenyl]acetamide::N-[2-[6-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-3-oxo-4H-quinoxalin-2-yl]phenyl]acetamide::SMR000128332::cid_9551426

SMILES: CC(=O)Nc1ccccc1-c1nc2ccc(cc2[nH]c1=O)C(=O)N1CCN(CC1)c1cc(C)ccc1C

InChI Key: InChIKey=DDYFSFPWRLZAMB-UHFFFAOYSA-N

Data: 5 EC50

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 = 47721   
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
RGS7


(Homo sapiens (Human))
BDBM47721
PNG
(MLS000523066 | N-[2-[6-[4-(2,5-dimethylphenyl)pipe...)
Show SMILES CC(=O)Nc1ccccc1-c1nc2ccc(cc2[nH]c1=O)C(=O)N1CCN(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C29H29N5O3/c1-18-8-9-19(2)26(16-18)33-12-14-34(15-13-33)29(37)21-10-11-24-25(17-21)32-28(36)27(31-24)22-6-4-5-7-23(22)30-20(3)35/h4-11,16-17H,12-15H2,1-3H3,(H,30,35)(H,32,36)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

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)


BindingDB Entry DOI: 10.7270/Q2PV6HS7
More data for this
Ligand-Target Pair
G protein signalling regulator 19


(Homo sapiens (Human))
BDBM47721
PNG
(MLS000523066 | N-[2-[6-[4-(2,5-dimethylphenyl)pipe...)
Show SMILES CC(=O)Nc1ccccc1-c1nc2ccc(cc2[nH]c1=O)C(=O)N1CCN(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C29H29N5O3/c1-18-8-9-19(2)26(16-18)33-12-14-34(15-13-33)29(37)21-10-11-24-25(17-21)32-28(36)27(31-24)22-6-4-5-7-23(22)30-20(3)35/h4-11,16-17H,12-15H2,1-3H3,(H,30,35)(H,32,36)
PDB
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Reactome pathway
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UniChem

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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)


BindingDB Entry DOI: 10.7270/Q2K35S27
More data for this
Ligand-Target Pair
regulator of G-protein signaling 4


(Homo sapiens (Human))
BDBM47721
PNG
(MLS000523066 | N-[2-[6-[4-(2,5-dimethylphenyl)pipe...)
Show SMILES CC(=O)Nc1ccccc1-c1nc2ccc(cc2[nH]c1=O)C(=O)N1CCN(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C29H29N5O3/c1-18-8-9-19(2)26(16-18)33-12-14-34(15-13-33)29(37)21-10-11-24-25(17-21)32-28(36)27(31-24)22-6-4-5-7-23(22)30-20(3)35/h4-11,16-17H,12-15H2,1-3H3,(H,30,35)(H,32,36)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

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)


BindingDB Entry DOI: 10.7270/Q2F76B0G
More data for this
Ligand-Target Pair
Regulator of G-protein signaling 8


(Homo sapiens (Human))
BDBM47721
PNG
(MLS000523066 | N-[2-[6-[4-(2,5-dimethylphenyl)pipe...)
Show SMILES CC(=O)Nc1ccccc1-c1nc2ccc(cc2[nH]c1=O)C(=O)N1CCN(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C29H29N5O3/c1-18-8-9-19(2)26(16-18)33-12-14-34(15-13-33)29(37)21-10-11-24-25(17-21)32-28(36)27(31-24)22-6-4-5-7-23(22)30-20(3)35/h4-11,16-17H,12-15H2,1-3H3,(H,30,35)(H,32,36)
PDB
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Reactome pathway
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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 (2009)


BindingDB Entry DOI: 10.7270/Q2TM78JD
More data for this
Ligand-Target Pair
regulator of G-protein signalling 16


(Homo sapiens (Human))
BDBM47721
PNG
(MLS000523066 | N-[2-[6-[4-(2,5-dimethylphenyl)pipe...)
Show SMILES CC(=O)Nc1ccccc1-c1nc2ccc(cc2[nH]c1=O)C(=O)N1CCN(CC1)c1cc(C)ccc1C
Show InChI InChI=1S/C29H29N5O3/c1-18-8-9-19(2)26(16-18)33-12-14-34(15-13-33)29(37)21-10-11-24-25(17-21)32-28(36)27(31-24)22-6-4-5-7-23(22)30-20(3)35/h4-11,16-17H,12-15H2,1-3H3,(H,30,35)(H,32,36)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

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)


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