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BDBM47772 4-(4-bromophenyl)-3-[1-(4-chlorophenyl)-5-methyl-1,2,3-triazol-4-yl]-1H-1,2,4-triazole-5-thione::4-(4-bromophenyl)-3-[1-(4-chlorophenyl)-5-methyl-4-triazolyl]-1H-1,2,4-triazole-5-thione::4-(4-bromophenyl)-3-[1-(4-chlorophenyl)-5-methyl-triazol-4-yl]-1H-1,2,4-triazole-5-thione::4-(4-bromophenyl)-3-[1-(4-chlorophenyl)-5-methyltriazol-4-yl]-1H-1,2,4-triazole-5-thione::4-(4-bromophenyl)-5-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4H-1,2,4-triazole-3-thiol::MLS000699614::SMR000229174::cid_9511214

SMILES: Cc1c(nnn1-c1ccc(Cl)cc1)-c1n[nH]c(=S)n1-c1ccc(Br)cc1

InChI Key: InChIKey=XYWAJEPWZZNSSR-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 = 47772   
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
Regulator of G-protein signaling 8


(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)
PDB
MMDB

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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/Q2TM78JD
More data for this
Ligand-Target Pair
RGS7


(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)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
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/Q2PV6HS7
More data for this
Ligand-Target Pair
regulator of G-protein signaling 4


(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)
PDB

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UniProtKB/TrEMBL

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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/Q2F76B0G
More data for this
Ligand-Target Pair
regulator of G-protein signalling 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)
PDB
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KEGG

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B.MOAD
antibodypedia
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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/Q2FB51BW
More data for this
Ligand-Target Pair
G protein signalling regulator 19


(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)
PDB
MMDB

Reactome pathway
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/Q2K35S27
More data for this
Ligand-Target Pair