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BDBM43167 1-[3-(3,4-dimethylanilino)-3-keto-propyl]isonipecotic acid ethyl ester::1-[3-(3,4-dimethylanilino)-3-oxopropyl]-4-piperidinecarboxylic acid ethyl ester::MLS000717790::SMR000279158::cid_740689::ethyl 1-[3-(3,4-dimethylanilino)-3-oxopropyl]piperidine-4-carboxylate::ethyl 1-[3-[(3,4-dimethylphenyl)amino]-3-oxidanylidene-propyl]piperidine-4-carboxylate

SMILES: CCOC(=O)C1CCN(CCC(=O)Nc2ccc(C)c(C)c2)CC1

InChI Key: InChIKey=HQOMKYWUOQWZJM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 43167   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
NCOA2 protein


(Homo sapiens (Human))
BDBM43167
PNG
(1-[3-(3,4-dimethylanilino)-3-keto-propyl]isonipeco...)
Show SMILES CCOC(=O)C1CCN(CCC(=O)Nc2ccc(C)c(C)c2)CC1
Show InChI InChI=1S/C19H28N2O3/c1-4-24-19(23)16-7-10-21(11-8-16)12-9-18(22)20-17-6-5-14(2)15(3)13-17/h5-6,13,16H,4,7-12H2,1-3H3,(H,20,22)
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PC cid
PC sid
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Similars

PCBioAssay
n/an/an/an/a>7.94E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2QZ28CS
More data for this
Ligand-Target Pair
nuclear receptor coactivator 3 isoform a


(Homo sapiens (Human))
BDBM43167
PNG
(1-[3-(3,4-dimethylanilino)-3-keto-propyl]isonipeco...)
Show SMILES CCOC(=O)C1CCN(CCC(=O)Nc2ccc(C)c(C)c2)CC1
Show InChI InChI=1S/C19H28N2O3/c1-4-24-19(23)16-7-10-21(11-8-16)12-9-18(22)20-17-6-5-14(2)15(3)13-17/h5-6,13,16H,4,7-12H2,1-3H3,(H,20,22)
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antibodypedia
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PC cid
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PCBioAssay
n/an/an/an/a>7.94E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center http://molscreen.florida.scripps.edu/ Center Affiliation: The ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2707ZV7
More data for this
Ligand-Target Pair
nuclear receptor coactivator 1 isoform 1


(Homo sapiens (Human))
BDBM43167
PNG
(1-[3-(3,4-dimethylanilino)-3-keto-propyl]isonipeco...)
Show SMILES CCOC(=O)C1CCN(CCC(=O)Nc2ccc(C)c(C)c2)CC1
Show InChI InChI=1S/C19H28N2O3/c1-4-24-19(23)16-7-10-21(11-8-16)12-9-18(22)20-17-6-5-14(2)15(3)13-17/h5-6,13,16H,4,7-12H2,1-3H3,(H,20,22)
PDB
MMDB

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antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>7.94E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FT8JGV
More data for this
Ligand-Target Pair