HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Trans-cinnamate 4-monooxygenase

External ID: CHEMBL3072500

Protocol: N/A

Comment: Journal: J Pesticide Sci
Year: 2005
Volume: 30
Issue: 4
First Page: 406
Last Page: 408
DOI: 10.1584/jpestics.30.406

Target ChEMBL ID: CHEMBL2268005
ChEMBL Target Name: Trans-cinnamate 4-monooxygenase
ChEMBL Target Type: SINGLE PROTEIN - Target is a single protein chain
Relationship Type: D - Direct protein target assigned
Confidence: Direct single protein target assigned

Standard Type	Standard Units	Activity Comment
Inhibition	%	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Fusarium verticillioides

External ID: CHEMBL3056248

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL613823
ChEMBL Target Name: Fusarium verticillioides
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	<	12	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Trans-cinnamate 4-monooxygenase

External ID: CHEMBL3072501

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: J Pesticide Sci
Year: 2005
Volume: 30
Issue: 4
First Page: 406
Last Page: 408
DOI: 10.1584/jpestics.30.406

Target ChEMBL ID: CHEMBL2268005
ChEMBL Target Name: Trans-cinnamate 4-monooxygenase
ChEMBL Target Type: SINGLE PROTEIN - Target is a single protein chain
Relationship Type: D - Direct protein target assigned
Confidence: Direct single protein target assigned

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
0.32	IC50	=	320	nM
100	IC50	>	100000	nM
3.6	IC50	=	3600	nM
100	IC50	>	100000	nM
3.9	IC50	=	3900	nM
100	IC50	>	100000	nM
5	IC50	=	5000	nM
45	IC50	=	45000	nM
100	IC50	>	100000	nM
45	IC50	=	45000	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Trichoderma

External ID: CHEMBL3056249

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL612872
ChEMBL Target Name: Trichoderma
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	<	12	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Saccharomyces cerevisiae

External ID: CHEMBL3056250

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL361
ChEMBL Target Name: Saccharomyces cerevisiae
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	<	12	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Aspergillus niger

External ID: CHEMBL3056251

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL358
ChEMBL Target Name: Aspergillus niger
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	<	12	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Fusarium verticillioides

External ID: CHEMBL3056252

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL613823
ChEMBL Target Name: Fusarium verticillioides
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Trichoderma

External ID: CHEMBL3056253

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL612872
ChEMBL Target Name: Trichoderma
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：11908 靶标：N/A

External ID: RMI-FANCM-MM2

Protocol: FP HTS. Screening took place at the University of Wisconsin Small Molecule Screening and Synthesis Facility. A master mix of RMI core complex and F-MM2 (30 microL per well) was plated in black 384 shallow well plates (ThermoFisher, Waltham, MA), using a BioTek "MicroFlo Select" reagent dispenser. Compounds were added using a Beckman FX liquid handler; 0.33 microL of 10 mM stock was added for a final compound concentration of 33 microM. MM2 and cMM2 were each added to 4 wells of master mix per plate to a final concentration of 10 muM to serve as controls. Following compound addition, plates were covered, centrifuged briefly, and incubated for 20 minutes at room temperature. FP measurements were taking using a Tecan "Safire 2" microplate reader. Instrument settings were as follows: top read, EX 470, EM 525/20, G-factor 0.89947. A suitable gain was calculated from the first plate of each day. Z' scores for were calculated for each plate; plates with Z' scores <0.5 were rerun prior to analysis.

Comment:

Concentration uM	Data readout
33	55
33	63
33	65
33	63
33	61
33	62
33	61
33	58
33	71
33	61
33	64
33	83
33	158
33	84
33	104
33	60
33	62
33	59
33	58
33	59

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Saccharomyces cerevisiae

External ID: CHEMBL3056254

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL361
ChEMBL Target Name: Saccharomyces cerevisiae
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Aspergillus niger

External ID: CHEMBL3056255

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL358
ChEMBL Target Name: Aspergillus niger
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Pseudomonas fluorescens

External ID: CHEMBL3056256

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL612500
ChEMBL Target Name: Pseudomonas fluorescens
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	=	16	mm
IZ	<	10	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Pseudomonas aeruginosa

External ID: CHEMBL3056257

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL348
ChEMBL Target Name: Pseudomonas aeruginosa
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	18	mm
IZ	=	16	mm
IZ	<	10	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Bacillus subtilis

External ID: CHEMBL3056258

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL359
ChEMBL Target Name: Bacillus subtilis
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	=	16	mm
IZ	<	10	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Escherichia coli

External ID: CHEMBL3056259

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL354
ChEMBL Target Name: Escherichia coli
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
IZ	=	16	mm
IZ	=	16	mm
IZ	<	10	mm
IZ	=	16	mm

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Entamoeba histolytica

External ID: CHEMBL2020421

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg Med Chem Lett
Year: 2012
Volume: 22
Issue: 8
First Page: 2768
Last Page: 2771
DOI: 10.1016/j.bmcl.2012.02.084

Target ChEMBL ID: CHEMBL612853
ChEMBL Target Name: Entamoeba histolytica
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
9.55	IC50	=	9550	nM
10.16	IC50	=	10160	nM
2.7	IC50	=	2700	nM
4.68	IC50	=	4680	nM
1.71	IC50	=	1710	nM
8.79	IC50	=	8790	nM
0.28	IC50	=	280	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Pseudomonas fluorescens

External ID: CHEMBL3056260

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL612500
ChEMBL Target Name: Pseudomonas fluorescens
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	5	ug.mL-1
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：MCF7

External ID: CHEMBL2020422

Protocol: N/A

Comment: Journal: Bioorg Med Chem Lett
Year: 2012
Volume: 22
Issue: 8
First Page: 2768
Last Page: 2771
DOI: 10.1016/j.bmcl.2012.02.084

Target ChEMBL ID: CHEMBL387
ChEMBL Target Name: MCF7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
	IC50				Not Determined
	IC50				Not Determined
	IC50				Not Determined
	IC50				Not Determined
	IC50				Not Determined
250	IC50	>	250000	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Pseudomonas aeruginosa

External ID: CHEMBL3056261

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL348
ChEMBL Target Name: Pseudomonas aeruginosa
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	5	ug.mL-1
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Bacillus subtilis

External ID: CHEMBL3056262

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL359
ChEMBL Target Name: Bacillus subtilis
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	5	ug.mL-1
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Escherichia coli

External ID: CHEMBL3056263

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2010
Volume: 19
Issue: 2
First Page: 127
Last Page: 135
DOI: 10.1007/s00044-009-9178-8

Target ChEMBL ID: CHEMBL354
ChEMBL Target Name: Escherichia coli
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
MIC	=	5	ug.mL-1
MIC	=	12.5	ug.mL-1
MIC	=	15	ug.mL-1
MIC	=	12.5	ug.mL-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Solanum tuberosum

External ID: CHEMBL3072499

Protocol: N/A

Comment: Journal: J Pesticide Sci
Year: 2005
Volume: 30
Issue: 4
First Page: 406
Last Page: 408
DOI: 10.1584/jpestics.30.406

Target ChEMBL ID: CHEMBL613053
ChEMBL Target Name: Solanum tuberosum
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value
FC	=	3

Concentration uM	Data readout
33	55
33	63
33	65
33	63
33	61
33	62
33	61
33	58
33	71
33	61
33	64
33	83
33	158
33	84
33	104
33	60
33	62
33	59
33	58
33	59

Concentration uM	Data readout
33	55
33	63
33	65
33	63
33	61
33	62
33	61
33	58
33	71
33	61
33	64
33	83
33	158
33	84
33	104
33	60
33	62
33	59
33	58
33	59

21089-45-2 靶点实验数据

Concentration uM	Data readout
33	55
33	63
33	65
33	63
33	61
33	62
33	61
33	58
33	71
33	61
33	64
33	83
33	158
33	84
33	104
33	60
33	62
33	59
33	58
33	59