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BDBM50148166 4-(4-Ethoxy-pyridin-2-ylamino)-piperidine-1-carboxylic acid ethyl ester::CHEMBL112198

SMILES: CCOC(=O)N1CCC(CC1)Nc1cc(OCC)ccn1

InChI Key: InChIKey=KGIKZYZMTIMJTM-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 = 50148166   
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
Nitric oxide synthase, brain


(Homo sapiens (Human))
BDBM50148166
PNG
(4-(4-Ethoxy-pyridin-2-ylamino)-piperidine-1-carbox...)
Show SMILES CCOC(=O)N1CCC(CC1)Nc1cc(OCC)ccn1
Show InChI InChI=1S/C15H23N3O3/c1-3-20-13-5-8-16-14(11-13)17-12-6-9-18(10-7-12)15(19)21-4-2/h5,8,11-12H,3-4,6-7,9-10H2,1-2H3,(H,16,17)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 9.60E+4n/an/an/an/an/an/a



AstraZeneca R&D Charnwood

Curated by ChEMBL


Assay Description
In vitro inhibition of human neuronal nitric oxide synthase.


J Med Chem 47: 3320-3 (2004)


Article DOI: 10.1021/jm031035n
BindingDB Entry DOI: 10.7270/Q25M656D
More data for this
Ligand-Target Pair
Nitric oxide synthase, inducible


(Homo sapiens (Human))
BDBM50148166
PNG
(4-(4-Ethoxy-pyridin-2-ylamino)-piperidine-1-carbox...)
Show SMILES CCOC(=O)N1CCC(CC1)Nc1cc(OCC)ccn1
Show InChI InChI=1S/C15H23N3O3/c1-3-20-13-5-8-16-14(11-13)17-12-6-9-18(10-7-12)15(19)21-4-2/h5,8,11-12H,3-4,6-7,9-10H2,1-2H3,(H,16,17)
PDB
MMDB

NCI pathway
Reactome pathway
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antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



AstraZeneca R&D Charnwood

Curated by ChEMBL


Assay Description
In vitro inhibition of human Inducible nitric oxide synthase.


J Med Chem 47: 3320-3 (2004)


Article DOI: 10.1021/jm031035n
BindingDB Entry DOI: 10.7270/Q25M656D
More data for this
Ligand-Target Pair
Nitric oxide synthase, endothelial


(Homo sapiens (Human))
BDBM50148166
PNG
(4-(4-Ethoxy-pyridin-2-ylamino)-piperidine-1-carbox...)
Show SMILES CCOC(=O)N1CCC(CC1)Nc1cc(OCC)ccn1
Show InChI InChI=1S/C15H23N3O3/c1-3-20-13-5-8-16-14(11-13)17-12-6-9-18(10-7-12)15(19)21-4-2/h5,8,11-12H,3-4,6-7,9-10H2,1-2H3,(H,16,17)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



AstraZeneca R&D Charnwood

Curated by ChEMBL


Assay Description
In vitro inhibition of human endothelial nitric oxide synthase.


J Med Chem 47: 3320-3 (2004)


Article DOI: 10.1021/jm031035n
BindingDB Entry DOI: 10.7270/Q25M656D
More data for this
Ligand-Target Pair