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BDBM87355 2-keto-1H-pyridine-3-carboxylic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester::2-oxo-1H-pyridine-3-carboxylic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester::MLS002245252::SMR001308907::[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 2-oxidanylidene-1H-pyridine-3-carboxylate::[2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 2-oxo-1H-pyridine-3-carboxylate::cid_2397406

SMILES: O=C(COC(=O)c1ccc[nH]c1=O)Nc1ccc(cc1)N1CCCCC1

InChI Key: InChIKey=VBYQESZTNWDYIO-UHFFFAOYSA-N

Data: 3 IC50

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 = 87355   
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
nuclear receptor coactivator 3 isoform a


(Homo sapiens (Human))
BDBM87355
PNG
(2-keto-1H-pyridine-3-carboxylic acid [2-keto-2-(4-...)
Show SMILES O=C(COC(=O)c1ccc[nH]c1=O)Nc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C19H21N3O4/c23-17(13-26-19(25)16-5-4-10-20-18(16)24)21-14-6-8-15(9-7-14)22-11-2-1-3-12-22/h4-10H,1-3,11-13H2,(H,20,24)(H,21,23)
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PC sid
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PCBioAssay
n/an/a 2.90E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2HT2MXV
More data for this
Ligand-Target Pair
Nuclear receptor coactivator 1


(Homo sapiens (Human))
BDBM87355
PNG
(2-keto-1H-pyridine-3-carboxylic acid [2-keto-2-(4-...)
Show SMILES O=C(COC(=O)c1ccc[nH]c1=O)Nc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C19H21N3O4/c23-17(13-26-19(25)16-5-4-10-20-18(16)24)21-14-6-8-15(9-7-14)22-11-2-1-3-12-22/h4-10H,1-3,11-13H2,(H,20,24)(H,21,23)
PDB
MMDB

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antibodypedia
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PC cid
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UniChem

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PCBioAssay
n/an/a>3.59E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q28914F2
More data for this
Ligand-Target Pair
Alpha trans-inducing protein (VP16)


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM87355
PNG
(2-keto-1H-pyridine-3-carboxylic acid [2-keto-2-(4-...)
Show SMILES O=C(COC(=O)c1ccc[nH]c1=O)Nc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C19H21N3O4/c23-17(13-26-19(25)16-5-4-10-20-18(16)24)21-14-6-8-15(9-7-14)22-11-2-1-3-12-22/h4-10H,1-3,11-13H2,(H,20,24)(H,21,23)
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>3.59E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2D21W6V
More data for this
Ligand-Target Pair