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BDBM22174 1-[(2S)-2-benzylpropyl]-4-{2-[bis(4-fluorophenyl)methoxy]ethyl}piperazine::GBR 12935 Analogue, (+)-7

SMILES: C[C@H](CN1CCN(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)Cc1ccccc1

InChI Key: InChIKey=QUOVWZCNMCSUEF-QHCPKHFHSA-N

Data: 2 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 2 hits for monomerid = 22174   
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 dopamine transporter


(Rattus norvegicus (rat))
BDBM22174
PNG
(1-[(2S)-2-benzylpropyl]-4-{2-[bis(4-fluorophenyl)m...)
Show SMILES C[C@H](CN1CCN(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)Cc1ccccc1 |r|
Show InChI InChI=1S/C29H34F2N2O/c1-23(21-24-5-3-2-4-6-24)22-33-17-15-32(16-18-33)19-20-34-29(25-7-11-27(30)12-8-25)26-9-13-28(31)14-10-26/h2-14,23,29H,15-22H2,1H3/t23-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
17 -9.85n/an/an/an/an/a7.44



National Taiwan University



Assay Description
The assay was initiated by the addition of membranes to binding buffer containing test compound, blocker, and radioligand. The samples were incubated...


J Med Chem 51: 2795-806 (2008)


Article DOI: 10.1021/jm701270n
BindingDB Entry DOI: 10.7270/Q2B27SK6
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM22174
PNG
(1-[(2S)-2-benzylpropyl]-4-{2-[bis(4-fluorophenyl)m...)
Show SMILES C[C@H](CN1CCN(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)Cc1ccccc1 |r|
Show InChI InChI=1S/C29H34F2N2O/c1-23(21-24-5-3-2-4-6-24)22-33-17-15-32(16-18-33)19-20-34-29(25-7-11-27(30)12-8-25)26-9-13-28(31)14-10-26/h2-14,23,29H,15-22H2,1H3/t23-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
120n/an/an/an/an/an/an/an/a



National Taiwan University



Assay Description
The assay was initiated by the addition of membranes to binding buffer containing test compound, blocker, and radioligand. The samples were incubated...


J Med Chem 51: 2795-806 (2008)


Article DOI: 10.1021/jm701270n
BindingDB Entry DOI: 10.7270/Q2B27SK6
More data for this
Ligand-Target Pair