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BDBM47781 5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-oxopentanoic acid::5-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]-5-oxopentanoic acid::5-[4-[hydroxy(diphenyl)methyl]piperidino]-5-keto-valeric acid::5-[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]-5-oxidanylidene-pentanoic acid::MLS000715040::SMR000275019::cid_1074070

SMILES: OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1

InChI Key: InChIKey=PKRFRRKXACIAGA-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 = 47781   
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))
BDBM47781
PNG
(5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-ox...)
Show SMILES OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H27NO4/c25-21(12-7-13-22(26)27)24-16-14-20(15-17-24)23(28,18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,28H,7,12-17H2,(H,26,27)
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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))
BDBM47781
PNG
(5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-ox...)
Show SMILES OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H27NO4/c25-21(12-7-13-22(26)27)24-16-14-20(15-17-24)23(28,18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,28H,7,12-17H2,(H,26,27)
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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))
BDBM47781
PNG
(5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-ox...)
Show SMILES OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H27NO4/c25-21(12-7-13-22(26)27)24-16-14-20(15-17-24)23(28,18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,28H,7,12-17H2,(H,26,27)
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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))
BDBM47781
PNG
(5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-ox...)
Show SMILES OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H27NO4/c25-21(12-7-13-22(26)27)24-16-14-20(15-17-24)23(28,18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,28H,7,12-17H2,(H,26,27)
PDB
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PC sid
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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))
BDBM47781
PNG
(5-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-5-ox...)
Show SMILES OC(=O)CCCC(=O)N1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H27NO4/c25-21(12-7-13-22(26)27)24-16-14-20(15-17-24)23(28,18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20,28H,7,12-17H2,(H,26,27)
PDB
MMDB

Reactome pathway
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UniProtKB/SwissProt

B.MOAD
antibodypedia
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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)


BindingDB Entry DOI: 10.7270/Q2K35S27
More data for this
Ligand-Target Pair