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Assay Detail

CHEMBL4028684

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Binding
Inhibition of Clostridium botulinum BoNT/A holotoxin-mediated SNAP-25 cleavage in mouse HBG3 cell-derived motor neurons preincubated for 30 mins followed by intoxication measured after 4 hrs by Western blot method
ChEMBL ↗
38
Total Activities
30
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Clostridium botulinum
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Botulinum neurotoxin type A (CHEMBL5192) ↗
Type SINGLE PROTEIN
Organism Clostridium botulinum

Publication

New Steroidal 4-Aminoquinolines Antagonize Botulinum Neurotoxin Serotype A in Mouse Embryonic Stem Cell Derived Motor Neurons in Postintoxication Model.
Konstantinović J, Kiris E, Kota KP, Kugelman-Tonos J, Videnović M, Cazares LH, Terzić Jovanović N, Verbić TŽ, Andjelković B, Duplantier AJ, Bavari S, Šolaja BA.
J Med Chem (2018) 61 : 1595 -1608
PubMed 29385334 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Inhibition 30 - -
IC50 8 5.06 5.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4098670 — — 2 5.30
CHEMBL4103115 — — 2 5.10
CHEMBL4092633 — — 2 5.00
CHEMBL4080629 — — 2 5.00
CHEMBL4070794 — — 2 5.00
CHEMBL4085175 — — 2 5.00
CHEMBL4081346 — — 2 5.00
CHEMBL4103981 — — 1 -
CHEMBL4091673 — — 1 -
CHEMBL4088496 — — 1 -
CHEMBL4088919 — — 1 -
CHEMBL4061909 — — 1 -
CHEMBL4076269 — — 1 -
CHEMBL4074926 — — 1 -
CHEMBL4095363 — — 1 -
CHEMBL4092916 — — 1 -
CHEMBL4065254 — — 1 -
CHEMBL4064938 — — 1 -
CHEMBL3264511 — — 1 -
CHEMBL3759740 — — 1 -
CHEMBL3759887 — — 1 -
CHEMBL3758840 — — 1 -
CHEMBL3759536 — — 1 -
CHEMBL4060273 — — 1 -
CHEMBL4095296 — — 1 -
CHEMBL4074856 — — 1 -
CHEMBL4069206 — — 1 -
CHEMBL4096220 — — 2 -
CHEMBL4079717 — — 1 -
CHEMBL4098680 — — 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4098670 — IC50 = 5000.0 nM 5.30
CHEMBL4103115 — IC50 = 8000.0 nM 5.10
CHEMBL4080629 — IC50 = 10000.0 nM 5.00
CHEMBL4092633 — IC50 = 10000.0 nM 5.00
CHEMBL4070794 — IC50 = 10000.0 nM 5.00
CHEMBL4085175 — IC50 = 10000.0 nM 5.00
CHEMBL4081346 — IC50 = 10000.0 nM 5.00
CHEMBL4060273 — Inhibition - % -
CHEMBL4070794 — Inhibition - % -
CHEMBL4088919 — Inhibition - % -
CHEMBL4061909 — Inhibition - % -
CHEMBL4076269 — Inhibition - % -
CHEMBL4081346 — Inhibition - % -
CHEMBL4074926 — Inhibition - % -
CHEMBL4095363 — Inhibition - % -
CHEMBL4085175 — Inhibition - % -
CHEMBL4103115 — Inhibition - % -
CHEMBL4092916 — Inhibition - % -
CHEMBL4065254 — Inhibition - % -
CHEMBL4064938 — Inhibition - % -
CHEMBL4092633 — Inhibition - % -
CHEMBL4091673 — Inhibition - % -
CHEMBL4080629 — Inhibition - % -
CHEMBL3264511 — Inhibition - % -
CHEMBL3759740 — Inhibition - % -
CHEMBL3759887 — Inhibition - % -
CHEMBL3758840 — Inhibition - % -
CHEMBL3759536 — Inhibition - % -
CHEMBL4098680 — Inhibition - % -
CHEMBL4095296 — Inhibition - % -
CHEMBL4088496 — Inhibition - % -
CHEMBL4069206 — Inhibition - % -
CHEMBL4096220 — Inhibition - % -
CHEMBL4096220 — IC50 < 10000.0 nM -
CHEMBL4079717 — Inhibition - % -
CHEMBL4103981 — Inhibition - % -
CHEMBL4098670 — Inhibition - % -
CHEMBL4074856 — Inhibition - % -