Assay Detail

CHEMBL3806366

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Binding

Binding affinity to Mycobacterium tuberculosis H37Rv wild type CYP121 by titration assay

ChEMBL ↗

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Target

Mycocyclosin synthase (CHEMBL1681615) ↗

Open DB target context

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Primary target Mycocyclosin synthase

CHEMBL1681615

Anchored from Assay target.

Protein identity Mycocyclosin synthase

Disease frame Disease evidence pending

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Review focus Open DB context pending

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Total Activities

Compounds Tested

Activity Types

Assay Parameters

Assay Information

Assay Type	Binding
Organism	Mycobacterium tuberculosis H37Rv
Confidence	8 — Homologous single protein target
Curated By	Autocuration

Target

Mycocyclosin synthase (CHEMBL1681615) ↗

Type	SINGLE PROTEIN
Organism	Mycobacterium tuberculosis

Publication

Fragment-Based Approaches to the Development of Mycobacterium tuberculosis CYP121 Inhibitors.

Kavanagh ME, Coyne AG, McLean KJ, James GG, Levy CW, Marino LB, de Carvalho LP, Chan DS, Hudson SA, Surade S, Leys D, Munro AW, Abell C.
J Med Chem (2016) 59 : 3272 -3302
PubMed 27002486 · DOI

Activity Statistics

Type	Count	Avg pChEMBL	Best pChEMBL
Kd	3	7.14	7.14

Compounds Tested

Compound	Name	Phase	Activities	Best pChEMBL
CHEMBL104	CLOTRIMAZOLE	4.0	1	7.14
CHEMBL808	ECONAZOLE	4.0	1	7.14
CHEMBL91	MICONAZOLE	4.0	1	7.14

Activity Data

Compound	Name	Type	Rel.	Value	Units	pChEMBL
CHEMBL104	CLOTRIMAZOLE	Kd	=	73.0	nM	7.14
CHEMBL808	ECONAZOLE	Kd	=	73.0	nM	7.14
CHEMBL91	MICONAZOLE	Kd	=	73.0	nM	7.14