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BDBM50017656 CHEMBL1193::Dimethyl-(3-phenyl-3-pyridin-2-yl-propyl)-amine::Naphcon-A::Opcon-A::PHENIRAMINE::Visine-A

SMILES: CN(C)CCC(c1ccccc1)c1ccccn1

InChI Key: InChIKey=IJHNSHDBIRRJRN-UHFFFAOYSA-N

Data: 1 KI  2 IC50  1 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 4 hits for monomerid = 50017656   
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
Histamine H4 receptor


(Homo sapiens (Human))
BDBM50017656
PNG
(CHEMBL1193 | Dimethyl-(3-phenyl-3-pyridin-2-yl-pro...)
Show SMILES CN(C)CCC(c1ccccc1)c1ccccn1
Show InChI InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3
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Article
PubMed
4.18E+3n/an/an/an/an/an/an/an/a



The Centre for Addiction and Mental Health

Curated by PDSP Ki Database




Mol Pharmacol 59: 427-33 (2001)


Article DOI: 10.1124/mol.59.3.427
BindingDB Entry DOI: 10.7270/Q22Z1438
More data for this
Ligand-Target Pair
Bile salt export pump


(Homo sapiens (Human))
BDBM50017656
PNG
(CHEMBL1193 | Dimethyl-(3-phenyl-3-pyridin-2-yl-pro...)
Show SMILES CN(C)CCC(c1ccccc1)c1ccccn1
Show InChI InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3
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PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-...


Drug Metab Dispos 40: 2332-41 (2012)


Article DOI: 10.1124/dmd.112.047068
BindingDB Entry DOI: 10.7270/Q2ZP488M
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50017656
PNG
(CHEMBL1193 | Dimethyl-(3-phenyl-3-pyridin-2-yl-pro...)
Show SMILES CN(C)CCC(c1ccccc1)c1ccccn1
Show InChI InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3
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PubMed
n/an/an/an/a 2.82E+4n/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H1 receptor in guinea pig ileum assessed as inhibition of histamine-induced contractions at 5 ug/ml


Bioorg Med Chem 16: 9009-17 (2008)


Article DOI: 10.1016/j.bmc.2008.08.039
BindingDB Entry DOI: 10.7270/Q2PR7ZSZ
More data for this
Ligand-Target Pair
Sodium channel protein type I I alpha subunit


(Homo sapiens (Human))
BDBM50017656
PNG
(CHEMBL1193 | Dimethyl-(3-phenyl-3-pyridin-2-yl-pro...)
Show SMILES CN(C)CCC(c1ccccc1)c1ccccn1
Show InChI InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3
PDB

KEGG

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antibodypedia
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antibodypedia
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n/an/a 3.30E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of binding of Batrachotoxinin [3H]BTX-B to high affinity sites on voltage dependent sodium channels in a vesicular preparation from guinea...


J Med Chem 28: 381-8 (1985)


BindingDB Entry DOI: 10.7270/Q2Z321T8
More data for this
Ligand-Target Pair