Skip to main content
Free research Free research Free assay review with research home and workspace preview
Quick search ChEMBL 36
Assay Detail

CHEMBL869110

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

Binding
Inhibition of Enterobacter cloacae Imi1
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Enterobacter cloacae
Confidence 9 — Direct single protein target
Curated By Expert

Target

Imipenem-hydrolyzing beta-lactamase (CHEMBL4314)
Type SINGLE PROTEIN
Organism Enterobacter cloacae

Publication

Structure-activity relationship of 6-methylidene penems bearing 6,5 bicyclic heterocycles as broad-spectrum beta-lactamase inhibitors: evidence for 1,4-thiazepine intermediates with C7 R stereochemistry by computational methods.
Venkatesan AM, Agarwal A, Abe T, Ushirogochi H, Yamamura I, Ado M, Tsuyoshi T, Dos Santos O, Gu Y, Sum FW, Li Z, Francisco G, Lin YI, Petersen PJ, Yang Y, Kumagai T, Weiss WJ, Shlaes DM, Knox JR, Mansour TS.
J Med Chem (2006) 49 : 4623 -4637
PubMed 16854068 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 7.31 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL212163 1 8.10
CHEMBL380061 1 8.05
CHEMBL212760 1 7.75
CHEMBL377382 1 7.70
CHEMBL212478 1 7.66
CHEMBL378041 1 7.57
CHEMBL379440 1 7.55
CHEMBL211143 1 7.40
CHEMBL378119 1 7.25
CHEMBL385593 1 7.05
CHEMBL379856 1 6.91
CHEMBL377001 1 6.38
CHEMBL425963 1 5.64
CHEMBL404 TAZOBACTAM 4.0 1 -
CHEMBL211889 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL212163 IC50 = 8.0 nM 8.10
CHEMBL380061 IC50 = 9.0 nM 8.05
CHEMBL212760 IC50 = 18.0 nM 7.75
CHEMBL377382 IC50 = 20.0 nM 7.70
CHEMBL212478 IC50 = 22.0 nM 7.66
CHEMBL378041 IC50 = 27.0 nM 7.57
CHEMBL379440 IC50 = 28.0 nM 7.55
CHEMBL211143 IC50 = 40.0 nM 7.40
CHEMBL378119 IC50 = 56.0 nM 7.25
CHEMBL385593 IC50 = 90.0 nM 7.05
CHEMBL379856 IC50 = 123.0 nM 6.91
CHEMBL377001 IC50 = 413.0 nM 6.38
CHEMBL425963 IC50 = 2300.0 nM 5.64
CHEMBL404 TAZOBACTAM IC50 - -
CHEMBL211889 IC50 > 10000.0 nM -