Choline (CID 305) - BioAssay Data Summary for Compound
.
BioActivity Outcomes:
Active(13)
 
 
Inactive(125)
 
 
Inconclusive(9)
 
 
Unspecified(54)
 
 
Top Targets:
MFS(18)
 
 
p450(10)
 
 
 
Neur chan LBD(4)
 
 
PIKKc TOR(4)
 
 
Pyr redox dim(4)
 
 
BioAssay Types:
Confirmatory(119)
 
 
 
Literature(34)
 
 
 
 
BioActivity Types:
Potency(98)
 
 
 
Ki(10)
 
 
IC50(9)
 
 
 
SAR
Target summary
Data download

Chemical Probe    Active    Inactive    Inconclusive    Unspecified   

Total Bioassays: 193    Data Row: 201   Total Pages: 5   Display: Page     
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#SubstanceActivityBioAssayTargetLinks
OutcomeTypeValue [μM]
1
[SID103240245]
IC50 1.6In vitro ability to inhibit the transport of [3H]choline in to high affinity choline transport system HAChT [AID52130, Type: Literature]
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2
[SID103240245]
Ki 18Binding affinity towards rat nicotinic acetylcholine receptor alpha2-beta2 expressed in HEK293 cells using [3H]EB as radioligand [AID145983, Type: Literature]Neuronal acetylcholine receptor subunit alpha-2 [gi:2851491]
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3
[SID103240245]
Ki 21Binding affinity towards rat alpha2-beta4 nACh receptor expressed in HEK293 cells using [3H]EB as radioligand [AID225720, Type: Literature]
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4
[SID103240245]
Ki 34Binding affinity towards rat Nicotinic acetylcholine receptor alpha4-beta4 expressed in HEK293 cells using [3H]EB as radioligand [AID146772, Type: Literature]Neuronal acetylcholine receptor subunit beta-4 [gi:113111]
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5
[SID103240245]
Ki 37Binding affinity towards rat Nicotinic acetylcholine receptor alpha3-beta2 expressed in HEK293 cells using [3H]EB as radioligand [AID146006, Type: Literature]Neuronal acetylcholine receptor subunit alpha-3 [gi:113061]
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6
[SID103240245]
Ki 37Binding affinity towards rat Nicotinic acetylcholine receptor alpha4-beta2 expressed in HEK293 cells using [3H]EB as radioligand [AID146486, Type: Literature]Neuronal acetylcholine receptor subunit beta-2 [gi:6226548]
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7
[SID103240245]
Ki 41Binding affinity to blood-brain barrier choline transporter in rat brain assessed as inhibition of [3H]choline uptake [AID344669, Type: Literature]
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8
[SID103240245]
Ki 41Binding affinity to blood-brain barrier choline transporter in rat brain assessed as inhibition of [3H]choline uptake [AID483710, Type: Literature]
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9
[SID103240245]
Ki 42Inhibition of [3H]-choline brain uptake was determined by in situ brain perfusion studies in male rats [AID52133, Type: Literature]
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10
[SID103240245]
Ki 42Binding affinity towards rat forebrain nicotinic acetylcholine receptor using [3H]EB as radioligand [AID145685, Type: Literature]
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11
[SID103240245]
Ki 48Binding affinity towards rat Nicotinic acetylcholine receptor alpha3-beta4 expressed in HEK293 cells using [3H]EB as radioligand [AID146162, Type: Literature]Neuronal acetylcholine receptor subunit alpha-3 [gi:113061]
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12
[SID46392765]
 Experimentally measured binding affinity data derived from PDB [AID1811, Type: Literature]Chain A, Multimodular Pneumococcal Cell Wall Endolysin From Phage Cp-1 Complexed With Choline [gi:38492607]
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13
[SID53812665]
 Experimentally measured binding affinity data derived from PDB [AID1811, Type: Literature]Chain A, Crystal Structure Of Mouse Acetylcholinesterase Complexed With Choline [gi:112491230]
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14
[SID103240245]
Km 42TP_TRANSPORTER: uptake in Oct1-expressing BALB/3T3 cells [AID680371, Type: other]Solute carrier family 22 member 1 [gi:189046191]
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15
[SID103240245]
IC50 55TP_TRANSPORTER: inhibition of MPP+ uptake (MPP+: 1 uM) in Xenopus laevis oocytes [AID678794, Type: other]Solute carrier family 22 member 1 [gi:189046191]
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16
[SID103240245]
Km 102TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID681960, Type: other]Solute carrier family 22 member 2 [gi:313104182]
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17
[SID103240245]
IC50 159TP_TRANSPORTER: inhibition of TEA uptake (TEA: 100 uM) in Xenopus laevis oocytes [AID678970, Type: other]Solute carrier family 22 member 2 [gi:81872789]
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18
[SID103240245]
Km 190TP_TRANSPORTER: uptake (electrogenesis) in Xenopus laevis oocytes [AID679159, Type: other]Solute carrier family 22 member 2 [gi:313104182]
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19
[SID103240245]
Km 210TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID678957, Type: other]Solute carrier family 22 member 2 [gi:313104182]
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20
[SID103240245]
IC50 217TP_TRANSPORTER: inhibition of MPP+ uptake (MPP+: 1 uM) in Xenopus laevis oocytes [AID678785, Type: other]Solute carrier family 22 member 2 [gi:81882176]
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21
[SID103240245]
Km 240TP_TRANSPORTER: uptake (electrogenesis,-50mV) in Xenopus laevis oocytes [AID679825, Type: other]Solute carrier family 22 member 1 [gi:81872095]
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22
[SID103240245]
Km 290Apparent Michaelis-Menten Constant (KM) for the acetylation of compound was calculated from Linewear-Burke plots by incubating for 10 minutes at 37 degrees Centigrade [AID52113, Type: Literature]
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23
[SID103240245]
Km 346TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID679188, Type: other]Solute carrier family 22 member 1 [gi:81872095]
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24
[SID103240245]
Km 370TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID678993, Type: other]Solute carrier family 22 member 1 [gi:81872095]
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25
[SID103240245]
IC50 398TP_TRANSPORTER: inhibition of TEA uptake (TEA: 100 uM) in Xenopus laevis oocytes [AID679826, Type: other]Solute carrier family 22 member 1 [gi:81872095]
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26
[SID103240245]
Km 441TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID681624, Type: other]Solute carrier family 22 member 2 [gi:81872789]
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27
[SID103240245]
Km 604TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID681589, Type: other]Solute carrier family 22 member 2 [gi:81872789]
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28
[SID103240245]
Km 1100TP_TRANSPORTER: uptake in Xenopus laevis oocytes [AID679314, Type: other]Solute carrier family 22 member 1 [gi:81872095]
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29
[SID103240245]
IC50 1450TP_TRANSPORTER: inhibition of TEA uptake (TEA: 50 uM) in OCT2-expressing MDCK cells [AID681345, Type: other]Solute carrier family 22 member 2 [gi:81872789]
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30
[SID103240245]
IC50 1452TP_TRANSPORTER: inhibition of TEA uptake (TEA: 50 uM) in OCT1-expressing MDCK cells [AID681348, Type: other]Solute carrier family 22 member 1 [gi:81872095]
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31
[SID103240245]
Km 2000TP_TRANSPORTER: uptake (electrogenesis) in Xenopus laevis oocytes [AID679635, Type: other]Solute carrier family 22 member 2 [gi:81872789]
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32
[SID103240245]
IC50 3013.01Inhibition acetylcholinesterase (AChE) enzyme. [AID32720, Type: Literature]
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33
[SID103240245]
 Rate of acetylation of 13.0+/-1.1 umol compound by 1 g of choline acetyltransferase (ChAc) by incubating for 10 minutes at 37 degrees Centigrade [AID51964, Type: Literature]
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34
[SID103240245]
 Apparent Michaelis-Menten Constant (Vmax) for the acetylation of compound [AID52115, Type: Literature]
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35
[SID103240245]
 Minimum concentration required to inhibit Pseudomonas aeruginosa ATCC 27853 [AID163955, Type: Literature]
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36
[SID103240245]
 Minimum concentration required to inhibit Pseudomonas aeruginosa ATCC 27853 [AID163958, Type: Literature]
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37
[SID103240245]
 Minimum concentration required to inhibit Staphylococcus aureus ATCC 25923 [AID207553, Type: Literature]
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38
[SID103240245]
 Minimum concentration required to inhibit Staphylococcus aureus ATCC 25923 [AID207555, Type: Literature]
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39
[SID103240245]
 Minimum concentration required to inhibit Enterococcus faecalis ATCC 29212 [AID68051, Type: Literature]
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40
[SID103240245]
 Minimum concentration required to inhibit Enterococcus faecalis ATCC 29212 [AID68053, Type: Literature]
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41
[SID103240245]
 Minimum concentration required to inhibit Escherichia coli ATCC 25922 [AID70621, Type: Literature]
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42
[SID103240245]
 Minimum concentration required to inhibit Escherichia coli ATCC 25922 [AID70623, Type: Literature]
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43
[SID103240245]
 Ratio between the binding affinities towards rat alpha2-beta4 and alpha2-beta2 nACh receptor using [3H]-EB as radioligand [AID231911, Type: Literature]
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44
[SID103240245]
 Ratio between the binding affinities towards rat alpha3-beta4 and alpha3-beta2 nACh receptor using [3H]EB as radioligand [AID231912, Type: Literature]
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45
[SID103240245]
 Ratio between the binding affinities towards rat alpha3-beta4 and forebrain nACh receptor using [3H]EB as radioligand [AID231914, Type: Literature]
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46
[SID103240245]
 Ratio between the binding affinities towards rat alpha4-beta4 and alpha4-beta2 nACh receptor using [3H]EB as radioligand [AID231915, Type: Literature]
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47
[SID103240245]
 Maximal response against Nicotinic acetylcholine receptor alpha 7 [AID242872, Type: Literature]
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48
[SID11110922]
 Cytochrome panel assay with activity outcomes [AID1851, Type: other]cytochrome P450, family 2, subfamily C, polypeptide 19 [Homo sapiens] [gi:4503219]
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49
[SID11110922]
 Cytochrome panel assay with activity outcomes [AID1851, Type: other]cytochrome P450, family 2, subfamily C, polypeptide 19 [Homo sapiens] [gi:4503219]
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50
[SID103240245]
 TP_TRANSPORTER: uptake in OCT2-expressing HEK-293 cells [AID681628, Type: other]Solute carrier family 22 member 2 [gi:81872789]
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