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BDBM87027 (R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)morpholine::(S)-2-((S)-(2,3-difluorophenoxy)(phenyl)methyl)morpholine::CAS_44450181::CAS_44450185::NSC_44450181::NSC_44450185

SMILES: Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F

InChI Key: InChIKey=IJMPFBJUROFOGZ-UHFFFAOYSA-N

Data: 6 KI

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 6 hits for monomerid = 87027   
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
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM87027
PNG
((R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)mor...)
Show SMILES Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F
Show InChI InChI=1S/C17H17F2NO2/c18-13-7-4-8-14(16(13)19)22-17(12-5-2-1-3-6-12)15-11-20-9-10-21-15/h1-8,15,17,20H,9-11H2
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PC sid
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Article
PubMed
10n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by PDSP Ki Database




Bioorg Med Chem Lett 18: 2562-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.050
BindingDB Entry DOI: 10.7270/Q2Z036RS
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM87027
PNG
((R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)mor...)
Show SMILES Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F
Show InChI InChI=1S/C17H17F2NO2/c18-13-7-4-8-14(16(13)19)22-17(12-5-2-1-3-6-12)15-11-20-9-10-21-15/h1-8,15,17,20H,9-11H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
10n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by PDSP Ki Database




Bioorg Med Chem Lett 18: 2562-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.050
BindingDB Entry DOI: 10.7270/Q2Z036RS
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM87027
PNG
((R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)mor...)
Show SMILES Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F
Show InChI InChI=1S/C17H17F2NO2/c18-13-7-4-8-14(16(13)19)22-17(12-5-2-1-3-6-12)15-11-20-9-10-21-15/h1-8,15,17,20H,9-11H2
Reactome pathway
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Article
PubMed
130n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by PDSP Ki Database




Bioorg Med Chem Lett 18: 2562-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.050
BindingDB Entry DOI: 10.7270/Q2Z036RS
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM87027
PNG
((R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)mor...)
Show SMILES Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F
Show InChI InChI=1S/C17H17F2NO2/c18-13-7-4-8-14(16(13)19)22-17(12-5-2-1-3-6-12)15-11-20-9-10-21-15/h1-8,15,17,20H,9-11H2
NCI pathway
Reactome pathway
KEGG

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GoogleScholar
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PC cid
PC sid
UniChem

Similars

Article
PubMed
380n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by PDSP Ki Database




Bioorg Med Chem Lett 18: 2562-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.050
BindingDB Entry DOI: 10.7270/Q2Z036RS
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM87027
PNG
((R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)mor...)
Show SMILES Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F
Show InChI InChI=1S/C17H17F2NO2/c18-13-7-4-8-14(16(13)19)22-17(12-5-2-1-3-6-12)15-11-20-9-10-21-15/h1-8,15,17,20H,9-11H2
NCI pathway
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Article
PubMed
2.60E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by PDSP Ki Database




Bioorg Med Chem Lett 18: 2562-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.050
BindingDB Entry DOI: 10.7270/Q2Z036RS
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM87027
PNG
((R)-2-((R)-(2,3-difluorophenoxy)(phenyl)methyl)mor...)
Show SMILES Fc1cccc(OC(C2CNCCO2)c2ccccc2)c1F
Show InChI InChI=1S/C17H17F2NO2/c18-13-7-4-8-14(16(13)19)22-17(12-5-2-1-3-6-12)15-11-20-9-10-21-15/h1-8,15,17,20H,9-11H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.39E+3n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by PDSP Ki Database




Bioorg Med Chem Lett 18: 2562-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.050
BindingDB Entry DOI: 10.7270/Q2Z036RS
More data for this
Ligand-Target Pair