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BDBM47775 MLS000621762::N-(2-chlorophenyl)-2-({3-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}thio)acetamide::N-(2-chlorophenyl)-2-[3-[3-(4-methylpiperidin-1-yl)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide::N-(2-chlorophenyl)-2-[3-[3-(4-methylpiperidin-1-yl)propyl]-4-oxoquinazolin-2-yl]sulfanylacetamide::N-(2-chlorophenyl)-2-[[3-[3-(4-methyl-1-piperidinyl)propyl]-4-oxo-2-quinazolinyl]thio]acetamide::N-(2-chlorophenyl)-2-[[4-keto-3-[3-(4-methylpiperidino)propyl]quinazolin-2-yl]thio]acetamide::SMR000310689::cid_4625345

SMILES: CC1CCN(CCCn2c(SCC(=O)Nc3ccccc3Cl)nc3ccccc3c2=O)CC1

InChI Key: InChIKey=KIQMPLDUQLNUGR-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 = 47775   
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))
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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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))
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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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))
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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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))
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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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))
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)
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/Q2K35S27
More data for this
Ligand-Target Pair