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Assay Detail

CHEMBL3591516

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ADMET
Binding affinity to human Kv11.1 expressed in HEK293 cell membranes assessed as binding affinity constant by [3H]dofetilide competition association assay
46
Total Activities
46
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Cell Type HEK293
Confidence 9 — Direct single protein target
Curated By Autocuration

Publication

Structure-Affinity Relationships (SARs) and Structure-Kinetics Relationships (SKRs) of Kv11.1 Blockers.
Yu Z, van Veldhoven JP, Louvel J, 't Hart IM, Rook MB, van der Heyden MA, Heitman LH, IJzerman AP.
J Med Chem (2015) 58 : 5916 -5929
PubMed 26125327 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 46 7.06 9.36

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3590463 1 9.36
CHEMBL3590452 1 9.14
CHEMBL3140084 1 8.92
CHEMBL3590464 1 8.72
CHEMBL3590446 1 8.52
CHEMBL3590465 1 8.40
CHEMBL2324244 1 8.21
CHEMBL3590462 1 7.92
CHEMBL3093959 1 7.80
CHEMBL3590458 1 7.75
CHEMBL3590445 1 7.70
CHEMBL3590457 1 7.47
CHEMBL3590456 1 7.44
CHEMBL3590466 1 7.43
CHEMBL3590447 1 7.39
CHEMBL3590444 1 7.28
CHEMBL3590470 1 7.22
CHEMBL3590495 1 7.14
CHEMBL3590453 1 7.07
CHEMBL3093953 1 7.07
CHEMBL3590501 1 7.00
CHEMBL3590448 1 7.00
CHEMBL3093972 1 7.00
CHEMBL3590500 1 6.99
CHEMBL3590499 1 6.98
CHEMBL3590496 1 6.90
CHEMBL3590450 1 6.88
CHEMBL2325212 1 6.88
CHEMBL3590497 1 6.87
CHEMBL3590467 1 6.82

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3590463 Kd = 0.44 nM 9.36
CHEMBL3590452 Kd = 0.73 nM 9.14
CHEMBL3140084 Kd = 1.2 nM 8.92
CHEMBL3590464 Kd = 1.9 nM 8.72
CHEMBL3590446 Kd = 3.0 nM 8.52
CHEMBL3590465 Kd = 4.0 nM 8.40
CHEMBL2324244 Kd = 6.1 nM 8.21
CHEMBL3590462 Kd = 12.0 nM 7.92
CHEMBL3093959 Kd = 16.0 nM 7.80
CHEMBL3590458 Kd = 18.0 nM 7.75
CHEMBL3590445 Kd = 20.0 nM 7.70
CHEMBL3590457 Kd = 34.0 nM 7.47
CHEMBL3590456 Kd = 36.0 nM 7.44
CHEMBL3590466 Kd = 37.0 nM 7.43
CHEMBL3590447 Kd = 41.0 nM 7.39
CHEMBL3590444 Kd = 53.0 nM 7.28
CHEMBL3590470 Kd = 60.0 nM 7.22
CHEMBL3590495 Kd = 72.0 nM 7.14
CHEMBL3590453 Kd = 85.0 nM 7.07
CHEMBL3093953 Kd = 86.0 nM 7.07
CHEMBL3590501 Kd = 100.0 nM 7.00
CHEMBL3590448 Kd = 99.0 nM 7.00
CHEMBL3093972 Kd = 100.0 nM 7.00
CHEMBL3590500 Kd = 103.0 nM 6.99
CHEMBL3590499 Kd = 105.0 nM 6.98
CHEMBL3590496 Kd = 125.0 nM 6.90
CHEMBL3590450 Kd = 132.0 nM 6.88
CHEMBL2325212 Kd = 132.0 nM 6.88
CHEMBL3590497 Kd = 135.0 nM 6.87
CHEMBL3590467 Kd = 153.0 nM 6.82
CHEMBL3590494 Kd = 203.0 nM 6.69
CHEMBL3590451 Kd = 247.0 nM 6.61
CHEMBL3590449 Kd = 260.0 nM 6.58
CHEMBL2325210 Kd = 368.0 nM 6.43
CHEMBL3590498 Kd = 440.0 nM 6.36
CHEMBL3590455 Kd = 591.0 nM 6.23
CHEMBL3590460 Kd = 637.0 nM 6.20
CHEMBL2325211 Kd = 1074.0 nM 5.97
CHEMBL3590459 Kd = 1188.0 nM 5.92
CHEMBL1464333 Kd = 1812.0 nM 5.74
CHEMBL3590468 Kd = 4258.0 nM 5.37
CHEMBL3590454 Kd = 5807.0 nM 5.24
CHEMBL2324257 Kd = 6631.0 nM 5.18
CHEMBL2324239 Kd = 8877.0 nM 5.05
CHEMBL3590469 Kd - -
CHEMBL3590461 Kd = 190546.0 nM -