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BDBM87043 (R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)methyl)morpholine::(S)-2-((S)-(4-fluoro-2-methoxyphenoxy)(phenyl)methyl)morpholine::CAS_44449768::CAS_44449792::NSC_44449768::NSC_44449792

SMILES: COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1

InChI Key: InChIKey=XSZZVXRYXJUWCA-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 = 87043   
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))
BDBM87043
PNG
((R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)meth...)
Show SMILES COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20FNO3/c1-21-16-11-14(19)7-8-15(16)23-18(13-5-3-2-4-6-13)17-12-20-9-10-22-17/h2-8,11,17-18,20H,9-10,12H2,1H3
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Article
PubMed
6n/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))
BDBM87043
PNG
((R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)meth...)
Show SMILES COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20FNO3/c1-21-16-11-14(19)7-8-15(16)23-18(13-5-3-2-4-6-13)17-12-20-9-10-22-17/h2-8,11,17-18,20H,9-10,12H2,1H3
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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 serotonin transporter


(Homo sapiens (Human))
BDBM87043
PNG
((R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)meth...)
Show SMILES COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20FNO3/c1-21-16-11-14(19)7-8-15(16)23-18(13-5-3-2-4-6-13)17-12-20-9-10-22-17/h2-8,11,17-18,20H,9-10,12H2,1H3
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22n/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))
BDBM87043
PNG
((R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)meth...)
Show SMILES COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20FNO3/c1-21-16-11-14(19)7-8-15(16)23-18(13-5-3-2-4-6-13)17-12-20-9-10-22-17/h2-8,11,17-18,20H,9-10,12H2,1H3
Reactome pathway
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Article
PubMed
610n/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))
BDBM87043
PNG
((R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)meth...)
Show SMILES COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20FNO3/c1-21-16-11-14(19)7-8-15(16)23-18(13-5-3-2-4-6-13)17-12-20-9-10-22-17/h2-8,11,17-18,20H,9-10,12H2,1H3
PDB

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antibodypedia
GoogleScholar
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PC cid
PC sid
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Article
PubMed
740n/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))
BDBM87043
PNG
((R)-2-((R)-(4-fluoro-2-methoxyphenoxy)(phenyl)meth...)
Show SMILES COc1cc(F)ccc1OC(C1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20FNO3/c1-21-16-11-14(19)7-8-15(16)23-18(13-5-3-2-4-6-13)17-12-20-9-10-22-17/h2-8,11,17-18,20H,9-10,12H2,1H3
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Article
PubMed
3.08E+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