Deguelin 0.15μM R05 exp209 [The Human Chemical-Genetic Interaction Map Project]

Derivative of rotenone, putative AKT inhibitor, complex I inhibitor

Class / Subclass 1: Signal Transduction / Kinase Inhibitor
Class / Subclass 2: Organelle Function / Mitochondrial Inhibitor

Compound References

PubChem Name: Deguelin
Synonyms: (-)-Deguelin; (-)-cis-Deguelin
CAS #: 522-17-8
PubChem CID: 107935
IUPAC: (1S,14S)-17,18-dimethoxy-7,7-dimethyl-2,8,21-trioxapentacyclo[12.8.0.03,12.04,9.015,20]docosa-3(12),4(9),5,10,15,17,19-heptaen-13-one
INCHI Name: InChI=1S/C23H22O6/c1-23(2)8-7-12-15(29-23)6-5-13-21(24)20-14-9-17(25-3)18(26-4)10-16(14)27-11-19(20)28-22(12)13/h5-10,19-20H,11H2,1-4H3/t19-,20+/m1/s1
INCHI Key: ORDAZKGHSNRHTD-UXHICEINSA-N
Molecular Weight: 394.4
Canonical SMILES: CC1(C=CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4C3=O)OC)OC)C
Isomeric SMILES: CC1(C=CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@H]4C3=O)OC)OC)C
Molecular Formula: C23H22O6

Compound Supplier

Supplier Name: Sigma-Aldrich
Catalog #: D0817
Lot #: N/A

Compound Characterization

HRMS (ESI-TOF) m/z: (M+H)+ Calcd for C23H22O6 395.14891; found 395.1502

Dose Response Curve

Platform ID: Deguelin
Min: -2.8408; Max: 53.9955

IC	Concentration (µM)
IC10	N/A
IC20	0.0361
IC30	0.1813
IC40	0.6806
IC50	2.2916
IC60	N/A
IC70	N/A
IC80	N/A
IC90	N/A

Screen Summary

Round: 05
Dose: 150nM
Days of incubation: 8
Doublings: 5.6
Numbers of reads: 18916253

Sensitive/Resistant hits (FDR<0.05)	CRANKS	Score Plot	Top 30 Genes	Screen Similarity	Top 30 Sensitive GO terms	Top 30 Resistant GO terms
1/4	Scores	View	View	View	View	View

Gene	CRANKS Score	FDR
GOT1	-3.44	<0.01
HPRT1	-2.60	0.13
MCM9	-2.60	0.13
SLC25A39	-2.52	0.13
CD86	-2.45	0.22
ORC3	-2.43	0.22
ZFP91	-2.24	0.25
DEXI	-2.16	0.34
KHDRBS1	-2.12	0.36
QRICH1	-2.11	0.50
ATP8B2	-2.11	0.57
CAPZB	-2.11	0.36
ATRNL1	-2.10	0.36
ATXN2	-2.03	0.50
TSC2	-2.03	0.48
ZNF202	-2.01	0.50
SUCLG1	-2.00	0.50
CAPZA1	-1.99	0.50
GCLC	-1.98	0.50
AQP11	-1.98	0.50
TRAPPC1	-1.96	0.50
RPL13A	-1.94	0.57
CARD9	-1.94	0.50
CPSF3L	-1.93	0.51
HS3ST3A1	-1.93	0.50
SUPT20HL2	-1.92	0.50
UBE2A	-1.92	0.50
SGSM1	-1.92	0.51
HRG	-1.92	0.50
MSI2	-1.91	0.50
WDR43	2.11	0.52
MAP3K10	2.13	0.16
MTA2	2.13	0.16
SLC25A3	2.14	0.16
CEPT1	2.16	0.16
TADA2A	2.17	0.16
RALGAPB	2.17	0.16
DHX38	2.18	0.41
FOXH1	2.18	0.16
C4BPA	2.19	0.16
SUPT6H	2.19	0.41
PDHA1	2.20	0.16
NUP160	2.23	0.48
LIG1	2.32	0.65
CMYA5	2.37	0.19
DDX3X	2.37	0.10
PSME3	2.39	0.10
PCDHGB4	2.44	0.12
GPT2	2.45	0.10
STPG1	2.46	0.12
RPL14	2.46	0.22
UTP3	2.52	0.16
AKAP7	2.63	0.05
MDH1	2.67	0.04
DNM2	2.68	0.38
NOP2	2.69	0.10
ATP5L	2.71	0.10
AGK	2.74	0.04
BRMS1	2.90	0.04
RPS9	2.93	0.24

Screen	Correlation	Plot
UM0131023 0.05μM R05 exp248	0.084	View
Citral 50μM R06 exp274	0.085	View
Chloramphenicol 20μM R00 exp13	0.073	View
Chloramphenicol 2μM R00 exp12	0.054	View
BAY-598 4μM R05 exp220	0.053	View

Last modified: 2026/01/15 21:36
by 127.0.0.1