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Assay Detail

CHEMBL2060770

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Binding
Binding affinity to biotinylated Escherichia coli FimH-lectin domain after 30 mins by biolayer interferometry method
27
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Lead optimization studies on FimH antagonists: discovery of potent and orally bioavailable ortho-substituted biphenyl mannosides.
Han Z, Pinkner JS, Ford B, Chorell E, Crowley JM, Cusumano CK, Campbell S, Henderson JP, Hultgren SJ, Janetka JW.
J Med Chem (2012) 55 : 3945 -3959
PubMed 22449031 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 27 8.65 9.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1170270 1 9.85
CHEMBL1171654 1 9.31
CHEMBL1170079 1 9.00
CHEMBL1172857 1 8.94
CHEMBL1171475 1 8.90
CHEMBL1170267 1 8.81
CHEMBL1171651 1 8.70
CHEMBL1172588 1 8.66
CHEMBL1169878 1 8.58
CHEMBL1172931 1 8.56
CHEMBL1173538 1 8.56
CHEMBL1170072 1 8.52
CHEMBL1172749 1 8.46
CHEMBL1171278 1 8.40
CHEMBL1171242 1 7.84
CHEMBL1170453 1 7.36
CHEMBL2058211 1 -
CHEMBL2058210 1 -
CHEMBL1172856 1 -
CHEMBL2058201 1 -
CHEMBL2058202 1 -
CHEMBL1172858 1 -
CHEMBL2058204 1 -
CHEMBL1171277 1 -
CHEMBL1171474 1 -
CHEMBL2058203 1 -
CHEMBL1170269 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1170270 Kd = 0.14 nM 9.85
CHEMBL1171654 Kd = 0.49 nM 9.31
CHEMBL1170079 Kd = 1.0 nM 9.00
CHEMBL1172857 Kd = 1.14 nM 8.94
CHEMBL1171475 Kd = 1.25 nM 8.90
CHEMBL1170267 Kd = 1.56 nM 8.81
CHEMBL1171651 Kd = 2.0 nM 8.70
CHEMBL1172588 Kd = 2.21 nM 8.66
CHEMBL1169878 Kd = 2.61 nM 8.58
CHEMBL1172931 Kd = 2.72 nM 8.56
CHEMBL1173538 Kd = 2.72 nM 8.56
CHEMBL1170072 Kd = 3.0 nM 8.52
CHEMBL1172749 Kd = 3.45 nM 8.46
CHEMBL1171278 Kd = 3.99 nM 8.40
CHEMBL1171242 Kd = 14.5 nM 7.84
CHEMBL1170453 Kd = 43.66 nM 7.36
CHEMBL2058211 Kd - -
CHEMBL2058210 Kd - -
CHEMBL1172856 Kd = 0.001 nM -
CHEMBL2058201 Kd - -
CHEMBL2058202 Kd - -
CHEMBL1172858 Kd - -
CHEMBL2058204 Kd - -
CHEMBL1171277 Kd = 0.008 nM -
CHEMBL1171474 Kd - -
CHEMBL2058203 Kd - -
CHEMBL1170269 Kd - -