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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50291008   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50291008
PNG
((3S,5S)-methyl 3-(4-iodophenyl)-8-(4-(1,3-dioxoiso...)
Show SMILES COC(=O)C1C2CCC(CC1c1ccc(I)cc1)N2CCCCN1C(=O)c2ccccc2C1=O |THB:2:4:18:6.7,11:10:18:6.7|
Show InChI InChI=1S/C27H29IN2O4/c1-34-27(33)24-22(17-8-10-18(28)11-9-17)16-19-12-13-23(24)29(19)14-4-5-15-30-25(31)20-6-2-3-7-21(20)26(30)32/h2-3,6-11,19,22-24H,4-5,12-16H2,1H3
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Article
0.210n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity of compound for Serotonin transporter with [3H]- paroxetine as radioligand in corpus striatum tissue from rat forebrain


Bioorg Med Chem Lett 7: 337-340 (1997)


Article DOI: 10.1016/S0960-894X(97)00009-7
BindingDB Entry DOI: 10.7270/Q2T72HGQ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50291008
PNG
((3S,5S)-methyl 3-(4-iodophenyl)-8-(4-(1,3-dioxoiso...)
Show SMILES COC(=O)C1C2CCC(CC1c1ccc(I)cc1)N2CCCCN1C(=O)c2ccccc2C1=O |THB:2:4:18:6.7,11:10:18:6.7|
Show InChI InChI=1S/C27H29IN2O4/c1-34-27(33)24-22(17-8-10-18(28)11-9-17)16-19-12-13-23(24)29(19)14-4-5-15-30-25(31)20-6-2-3-7-21(20)26(30)32/h2-3,6-11,19,22-24H,4-5,12-16H2,1H3
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Article
2.40n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity of compound for Dopamine transporter with [3H]- GBR-12935 as radioligand in corpus striatum tissue from rat forebrain


Bioorg Med Chem Lett 7: 337-340 (1997)


Article DOI: 10.1016/S0960-894X(97)00009-7
BindingDB Entry DOI: 10.7270/Q2T72HGQ
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus)
BDBM50291008
PNG
((3S,5S)-methyl 3-(4-iodophenyl)-8-(4-(1,3-dioxoiso...)
Show SMILES COC(=O)C1C2CCC(CC1c1ccc(I)cc1)N2CCCCN1C(=O)c2ccccc2C1=O |THB:2:4:18:6.7,11:10:18:6.7|
Show InChI InChI=1S/C27H29IN2O4/c1-34-27(33)24-22(17-8-10-18(28)11-9-17)16-19-12-13-23(24)29(19)14-4-5-15-30-25(31)20-6-2-3-7-21(20)26(30)32/h2-3,6-11,19,22-24H,4-5,12-16H2,1H3
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Article
190n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity of compound for Norepinephrine (NE) transporter with [3H]- nisoxatine as radioligand in corpus striatum tissue from rat for...


Bioorg Med Chem Lett 7: 337-340 (1997)


Article DOI: 10.1016/S0960-894X(97)00009-7
BindingDB Entry DOI: 10.7270/Q2T72HGQ
More data for this
Ligand-Target Pair