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Assay Detail

CHEMBL933608

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Displacement of [3H]vesamicol from VAChT receptor in torpedo electrical organ synaptic vesicle
40
Total Activities
37
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Torpedo
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

First CoMFA characterization of vesamicol analogs as ligands for the vesicular acetylcholine transporter.
Szymoszek A, Wenzel B, Scheunemann M, Steinbach J, Schüürmann G.
J Med Chem (2008) 51 : 2128 -2136
PubMed 18324757 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 40 6.80 8.12

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL20730 VESAMICOL 2 8.12
CHEMBL339712 2 5.47
CHEMBL127180 1 -
CHEMBL405524 1 -
CHEMBL260826 1 -
CHEMBL410246 1 -
CHEMBL340816 1 -
CHEMBL409052 1 -
CHEMBL411267 1 -
CHEMBL427560 1 -
CHEMBL408946 1 -
CHEMBL341139 1 -
CHEMBL262612 1 -
CHEMBL264437 1 -
CHEMBL264438 1 -
CHEMBL20463 1 -
CHEMBL261717 2 -
CHEMBL87379 BENZOVESAMICOL 1 -
CHEMBL261716 1 -
CHEMBL129530 1 -
CHEMBL1795069 1 -
CHEMBL330635 1 -
CHEMBL330386 1 -
CHEMBL95857 1 -
CHEMBL318675 1 -
CHEMBL95701 1 -
CHEMBL87287 1 -
CHEMBL315146 1 -
CHEMBL87652 1 -
CHEMBL50880 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL20730 VESAMICOL Ki = 7.6 nM 8.12
CHEMBL339712 Ki = 3400.0 nM 5.47
CHEMBL408946 Ki = 14454397707.46 nM -
CHEMBL127180 Ki = 74131024130.09 nM -
CHEMBL427560 Ki = 323593656929.63 nM -
CHEMBL411267 Ki = 8511380382.02 nM -
CHEMBL409052 Ki = 8511380382.02 nM -
CHEMBL339712 Ki = 3388441561392.02 nM -
CHEMBL340816 Ki = 588843655355.59 nM -
CHEMBL410246 Ki = 10232929922.81 nM -
CHEMBL260826 Ki = 295120922666.64 nM -
CHEMBL405524 Ki = 575439937337.16 nM -
CHEMBL20730 VESAMICOL Ki = 7585775750.29 nM -
CHEMBL338140 Ki = 416869383470.34 nM -
CHEMBL340185 Ki = 85113803820.24 nM -
CHEMBL126257 Ki = 181970085861.0 nM -
CHEMBL126019 Ki = 602559586074.36 nM -
CHEMBL339491 Ki = 77624711662.87 nM -
CHEMBL87435 Ki = 18197008586.1 nM -
CHEMBL87594 Ki = 363078054.77 nM -
CHEMBL1795069 Ki = 120226443.46 nM -
CHEMBL129530 Ki = 436515832.24 nM -
CHEMBL315146 Ki = 7585775750.29 nM -
CHEMBL87652 Ki = 23988329190.19 nM -
CHEMBL87287 Ki = 6918309709.19 nM -
CHEMBL95701 Ki = 398107170.55 nM -
CHEMBL318675 Ki = 10000000000.0 nM -
CHEMBL95857 Ki = 1000000000.0 nM -
CHEMBL330386 Ki = 5248074602.5 nM -
CHEMBL330635 Ki = 436515832.24 nM -
CHEMBL50880 Ki = 707945784.38 nM -
CHEMBL341139 Ki = 85113803820.24 nM -
CHEMBL261716 Ki = 416869383.47 nM -
CHEMBL87379 BENZOVESAMICOL Ki = 54954087.39 nM -
CHEMBL261717 Ki = 8912509.38 nM -
CHEMBL20463 Ki = 67608297.54 nM -
CHEMBL264438 Ki = 630957344.48 nM -
CHEMBL264437 Ki = 338844156.14 nM -
CHEMBL262612 Ki = 323593656.93 nM -
CHEMBL261717 Ki = 0.009 nM -