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BDBM67699 (3-chloranyl-6-nitro-1-benzothiophen-2-yl)-piperazin-1-yl-methanone::(3-chloro-6-nitro-1-benzothiophen-2-yl)-(1-piperazinyl)methanone::(3-chloro-6-nitro-1-benzothiophen-2-yl)-piperazin-1-ylmethanone::(3-chloro-6-nitro-benzothiophen-2-yl)-piperazino-methanone::KSC-1-99c::KUC103872N::cid_4496360

SMILES: [O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)N1CCNCC1

InChI Key: InChIKey=YSSCJSZEFBLRIZ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 67699   
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
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens (Human))
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
PDB
MMDB

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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 (2010)


BindingDB Entry DOI: 10.7270/Q269721H
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens (Human))
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
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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Article
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 (2010)


Article DOI: 10.1021/bi4011286
BindingDB Entry DOI: 10.7270/Q2T43RJV
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens (Human))
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
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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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 (2010)


BindingDB Entry DOI: 10.7270/Q2XS5SVJ
More data for this
Ligand-Target Pair
Guanine nucleotide-binding protein G(o), alpha subunit 1


(Homo sapiens (Human))
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
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

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 (2010)


BindingDB Entry DOI: 10.7270/Q22J699S
More data for this
Ligand-Target Pair