QNZ 0.01μM R08 exp439

Inhibits NF-κB activation, TNF-α production

Class / Subclass 1: Gene Regulation / Transcription Inhibitor
Class / Subclass 2: Signal Transduction / Apoptosis Inhibitor

Compound References

PubChem Name: 6-Amino-4-(4-phenoxyphenylethylamino)quinazoline
Synonyms: EVP4593
CAS #: 545380-34-5
PubChem CID: 509554
IUPAC: 4-N-[2-(4-phenoxyphenyl)ethyl]quinazoline-4,6-diamine
INCHI Name: InChI=1S/C22H20N4O/c23-17-8-11-21-20(14-17)22(26-15-25-21)24-13-12-16-6-9-19(10-7-16)27-18-4-2-1-3-5-18/h1-11,14-15H,12-13,23H2,(H,24,25,26)
INCHI Key: IBAKVEUZKHOWNG-UHFFFAOYSA-N
Molecular Weight: 356.4
Canonical SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)CCNC3=NC=NC4=C3C=C(C=C4)N
Isomeric SMILES: N/A
Molecular Formula: C22H20N4O

Compound Supplier

Supplier Name: Toronto Research Chemicals
Catalog #: A621350
Lot #: N/A

Compound Characterization

HRMS (ESI-TOF) m/z: (M+H)+ Calcd for C22H20N4O 357.17099; found 357.17163

Dose Response Curve

Platform ID: QNZ
Min: -6.9131; Max: 34.7243

IC	Concentration (µM)
IC10	0.0002
IC20	0.0016
IC30	0.0065
IC40	0.0202
IC50	N/A
IC60	N/A
IC70	N/A
IC80	N/A
IC90	N/A

Screen Summary

Round: 08
Dose: 10nM
Days of incubation: 8
Doublings: 2.7
Numbers of reads: 18688792

Sensitive/Resistant hits (FDR<0.05)	CRANKS	Score Plot	Top 30 Genes	Screen Similarity	Top 30 Sensitive GO terms	Top 30 Resistant GO terms
7/32	Scores	View	View	View	View	View

Gene	CRANKS Score	FDR
GOT1	-4.36	<0.01
PFKP	-3.00	<0.01
HADH	-2.93	<0.01
SUCLG1	-2.90	<0.01
GCDH	-2.80	0.01
SUCLA2	-2.77	0.01
AHCYL1	-2.75	0.04
DLST	-2.60	0.08
OTUB1	-2.59	0.05
NPRL3	-2.54	0.10
ATP1A1	-2.53	0.07
MDM2	-2.53	0.10
UBE2QL1	-2.52	0.20
PRKAA1	-2.47	0.05
TBC1D3L	-2.46	0.34
LIPT1	-2.45	0.05
TBC1D3K	-2.45	0.34
HPRT1	-2.44	0.05
AMBRA1	-2.44	0.08
OR4F21	-2.42	0.26
TBC1D3E	-2.38	0.36
PIGO	-2.37	0.19
CCDC47	-2.33	0.08
TBC1D3I	-2.32	0.37
DCP1A	-2.32	0.08
LIPT2	-2.27	0.25
C8orf47	-2.25	0.10
YRDC	-2.17	0.47
ACIN1	-2.16	0.22
ADK	-2.16	0.14
SPATA4	2.33	0.04
CTU2	2.35	0.05
MARCH5	2.36	0.05
SELRC1	2.39	0.03
DARS2	2.44	0.18
G3BP1	2.45	0.02
DPH1	2.47	0.02
G6PD	2.48	0.02
IKZF1	2.50	0.02
NARS2	2.51	0.02
TP53	2.52	0.03
ATP5B	2.57	0.02
ATP5O	2.58	0.02
ACSL4	2.61	0.02
MTHFD2	2.62	0.02
RBM7	2.63	0.04
PMVK	2.67	0.02
FAF2	2.72	0.03
SLC25A3	2.76	<0.01
KDM3B	2.76	0.02
ATP5A1	2.81	0.02
PTPMT1	2.86	0.04
SLC25A52	2.89	<0.01
ACSL3	3.14	<0.01
SHMT2	3.34	<0.01
IPPK	3.38	<0.01
C7orf26	3.57	<0.01
IPMK	3.84	<0.01
ITPK1	4.10	<0.01
SLC25A51	4.79	<0.01

Screen	Correlation	Plot
Rotenone 0.07μM R08 exp431	0.212	View
Thimerosal 0.85μM R08 exp529	0.066	View
iCRT14 30μM R08 exp492	0.057	View
Mubritinib 0.2μM R01 exp48	0.134	View
Chloramphenicol 20μM R00 exp13	0.107	View
Phenformin 20μM R05 exp212	0.105	View
QNZ 0.01μM R05 exp241	0.099	View
Amiloride 100μM R08 exp447	0.093	View
NMS-873 0.07μM R07 exp380	0.088	View
Mubritinib 0.2μM R02 exp65	0.083	View
LLY-283 2.6μM R06 exp290	0.063	View
Hippuristanol 0.12μM R08 exp488	0.059	View
Citral 75μM R06 exp275	0.058	View
MS023 7μM R03 exp135	0.057	View
Phenformin 20μM R03 exp143	0.056	View
Citral 50μM R06 exp274	0.055	View
Mitomycin-C 0.06μM R08 exp503	0.054	View
Atovaquone 15μM R08 exp451	0.053	View
∆-9-Tetrahydrocannabinol 30μM R08 exp445	0.053	View
Cannabidiol 20μM R08 exp466	0.053	View
Hippuristanol 0.12μM R08 exp489 no dilution day6	0.052	View
AICAR 240μM R03 exp116	0.052	View

GO Term	Fold Change	Genes
succinate-CoA ligase activity	613.67	SUCLG1,SUCLA2
GMP salvage	306.83	HPRT1,ADK
protein lipoylation	306.83	LIPT1,LIPT2
succinyl-CoA metabolic process	204.56	SUCLG1,SUCLA2,DLST
purine ribonucleoside salvage	204.56	HPRT1,ADK
tricarboxylic acid cycle	57.53	SUCLG1,SUCLA2,DLST
acyl-CoA metabolic process	28.21	SUCLG1,GCDH,SUCLA2,DLST
purine nucleoside bisphosphate metabolic process	21.34	SUCLG1,GCDH,SUCLA2,DLST
ribonucleoside bisphosphate metabolic process	21.34	SUCLG1,GCDH,SUCLA2,DLST
nucleoside bisphosphate metabolic process	21.34	SUCLG1,GCDH,SUCLA2,DLST
purine ribonucleotide metabolic process	11.58	SUCLG1,GCDH,SUCLA2,DLST,HPRT1,ADK
ribonucleotide metabolic process	10.93	SUCLG1,GCDH,SUCLA2,DLST,HPRT1,ADK
ribose phosphate metabolic process	10.67	SUCLG1,GCDH,SUCLA2,DLST,HPRT1,ADK
purine nucleotide metabolic process	9.27	SUCLG1,GCDH,SUCLA2,DLST,HPRT1,ADK
mitochondrial matrix	9.06	HADH,SUCLG1,GCDH,SUCLA2,DLST,LIPT1,LIPT2
carboxylic acid metabolic process	6.86	GOT1,PFKP,HADH,GCDH,SUCLA2,DLST,PRKAA1,LIPT1,LIPT2
oxoacid metabolic process	6.68	GOT1,PFKP,HADH,GCDH,SUCLA2,DLST,PRKAA1,LIPT1,LIPT2
organic acid metabolic process	6.62	GOT1,PFKP,HADH,GCDH,SUCLA2,DLST,PRKAA1,LIPT1,LIPT2
organophosphate metabolic process	5.70	PFKP,SUCLG1,GCDH,SUCLA2,DLST,HPRT1,PIGO,ADK

GO Term	Fold Change	Genes
palmitoyl-CoA ligase activity	552.30	ACSL3,ACSL4
angiostatin binding	368.20	ATP5F1A,ATP5F1B
proton-transporting ATP synthase complex, catalytic core F(1)	331.38	ATP5F1A,ATP5PO,ATP5F1B
proton-transporting ATP synthase activity, rotational mechanism	118.35	ATP5F1A,ATP5PO,ATP5F1B
mitochondrial proton-transporting ATP synthase complex	110.46	ATP5F1A,ATP5PO,ATP5F1B
proton-transporting two-sector ATPase complex, catalytic domain	97.46	ATP5F1A,ATP5PO,ATP5F1B
necroptotic process	87.21	ITPK1,IPMK,TP53
ligase activity	24.62	ACSL3,ATP5F1A,ACSL4,ATP5PO,ATP5F1B,NARS2,DARS2
ribose phosphate biosynthetic process	17.08	ACSL3,ATP5F1A,ACSL4,ATP5PO,ATP5F1B,G6PD
purine-containing compound biosynthetic process	15.13	SHMT2,ACSL3,ATP5F1A,ACSL4,ATP5PO,ATP5F1B
organophosphate biosynthetic process	10.70	IPMK,IPPK,ACSL3,PTPMT1,ATP5F1A,PMVK,ACSL4,ATP5PO,ATP5F1B,G6PD
purine-containing compound metabolic process	10.40	SHMT2,ACSL3,ATP5F1A,PMVK,ACSL4,ATP5PO,ATP5F1B,G6PD
purine nucleotide metabolic process	9.74	ACSL3,ATP5F1A,PMVK,ACSL4,ATP5PO,ATP5F1B,G6PD
mitochondrial inner membrane	9.65	SLC25A51,SHMT2,SLC25A52,PTPMT1,ATP5F1A,SLC25A3,ATP5PO,ATP5F1B
mitochondrial envelope	8.83	SLC25A51,SHMT2,ACSL3,SLC25A52,PTPMT1,ATP5F1A,SLC25A3,ACSL4,ATP5PO,ATP5F1B,COA7,MARCHF5
organelle inner membrane	8.66	SLC25A51,SHMT2,SLC25A52,PTPMT1,ATP5F1A,SLC25A3,ATP5PO,ATP5F1B
mitochondrial membrane	8.62	SLC25A51,SHMT2,ACSL3,SLC25A52,PTPMT1,ATP5F1A,SLC25A3,ACSL4,ATP5PO,ATP5F1B,MARCHF5
nucleobase-containing small molecule metabolic process	8.29	SHMT2,ACSL3,ATP5F1A,PMVK,ACSL4,ATP5PO,ATP5F1B,G6PD
organophosphate metabolic process	7.06	ITPK1,IPMK,IPPK,ACSL3,PTPMT1,ATP5F1A,PMVK,ACSL4,ATP5PO,ATP5F1B,G6PD

QNZ 0.01μM R08 exp439

Mechanism of Action

Technical Notes

Compound References

Compound Supplier

Compound Characterization

Dose Response Curve

Screen Summary

Screen Results