Table of Contents
B02 10μM R08 exp453
Mechanism of Action
Technical Notes
Screen Summary
Screen Results
B02 10μM R08 exp453
Mechanism of Action
Inhibits RAD51 recombinase, blocks homologous recombination
Class / Subclass 1:
DNA Damage, Repair and Replication / Repair Protein Inhibitor
Technical Notes
Compound References
PubChem Name:
RAD51 inhibitor B02
Synonyms:
B02
CAS #:
1290541-46-6
PubChem CID:
5738263
IUPAC:
3-benzyl-2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-one
INCHI Name:
InChI=1S/C22H17N3O/c26-22-19-10-4-5-11-20(19)24-21(13-12-17-9-6-14-23-15-17)25(22)16-18-7-2-1-3-8-18/h1-15H,16H2/b13-12+
INCHI Key:
GEKDQXSPTHHANP-OUKQBFOZSA-N
Molecular Weight:
339.4
Canonical SMILES:
C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C3C2=O)C=CC4=CN=CC=C4
Isomeric SMILES:
C1=CC=C(C=C1)CN2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CN=CC=C4
Molecular Formula:
C22H17N3O
Compound Supplier
Supplier Name:
Cayman Chemical
Catalog #:
22133
Lot #:
N/A
Compound Characterization
HRMS (ESI-TOF) m/z:
(M+H)+ Calcd for C22 H17 N3 O 340.14444; found 340.14521
Dose Response Curve
Dose response curve not available.
Screen Summary
Round
: 08
Dose
: 10µM
Days of incubation
: 8
Doublings
: 5.0
Numbers of reads
: 15314133
Screen Results
Sensitive/Resistant hits (FDR<0.05)
CRANKS
Score Plot
Top 30 Genes
Screen Similarity
Top 30 Sensitive GO terms
Top 30 Resistant GO terms
11/0
Scores
View
View
View
View
View
×
B02 10μM R08 exp453
×
Top 30 S/R Genes
Gene
CRANKS Score
FDR
KDSR
-4.32
<0.01
TTC37
-4.26
<0.01
UXS1
-4.07
<0.01
FLVCR1
-3.78
<0.01
ALG9
-3.37
<0.01
KIF18A
-3.32
<0.01
FDPS
-2.74
0.03
SKIV2L
-2.70
0.06
RABGEF1
-2.60
0.05
DNAJC3
-2.59
0.03
ARL2
-2.52
0.13
TSSC1
-2.49
0.04
FBXO7
-2.46
0.04
SEC16A
-2.37
0.20
ILF3
-2.31
0.29
NCDN
-2.29
0.10
TBCD
-2.26
0.20
CSK
-2.23
0.13
RCE1
-2.21
0.13
TUT1
-2.20
0.20
LCMT1
-2.19
0.14
ARL1
-2.17
0.14
NAPG
-2.14
0.15
SLC5A3
-2.14
0.15
ADAR
-2.14
0.19
ALG6
-2.12
0.16
KIAA1432
-2.12
0.20
HIST1H1B
-2.10
0.17
LAMTOR4
-2.09
0.17
TNFAIP2
-2.09
0.26
HEXIM1
2.00
0.30
TFIP11
2.00
0.30
RPS19BP1
2.01
0.30
MYH7B
2.01
0.48
AKT1
2.02
0.30
DNAJC17
2.03
0.51
CORT
2.07
0.24
PCCB
2.09
0.24
SMC1B
2.12
0.21
XRN2
2.14
0.49
HLA-C
2.16
0.18
ARID4A
2.16
0.18
GTPBP4
2.19
0.46
ALDH1A3
2.22
0.16
RICTOR
2.24
0.15
PML
2.24
0.15
UBE4B
2.26
0.15
ENO2
2.30
0.18
RPS15A
2.30
0.64
RMI2
2.33
0.15
RBM38
2.36
0.15
PAQR6
2.38
0.15
POLR2J2
2.39
0.62
HTRA2
2.53
0.13
NCBP1
2.53
0.24
CD19
2.56
0.15
NPRL2
2.61
0.15
RHOH
2.65
0.13
CEP192
2.68
0.15
SHMT2
3.13
0.08
×
Correlated Screens
Screen
Correlation
Plot
FTY720 3μM R08 exp483
0.077
View
Sulforaphane 9μM R08 exp525
0.076
View
Trametinib 10μM R02 exp83
0.071
View
Lead acetate 2000μM R08 exp498 no dilution day6
0.069
View
NN-Dimethylsphingosine 2.5μM R08 exp508
0.068
View
LJH685 50μM R08 exp433
0.066
View
Bisphenol F 50μM R08 exp457
0.066
View
FK-506 30μM R07 exp359
0.065
View
Benzoate 10000μM R08 exp455
0.064
View
Ibrutinib 10μM R08 exp442
0.063
View
Hydroxychloroquine 30μM R08 exp490
0.063
View
Thioridazine 5μM R08 exp530
0.062
View
EPZ-5676 30μM R05 exp233
0.059
View
Chloroquine 32μM R08 exp470
0.057
View
Sulforaphane 9μM R08 exp526 no dilution day6
0.057
View
Chlorpromazine 10μM R07 exp344
0.056
View
UM0011500 5μM R05 exp245
0.056
View
NN-Diethyl-meta-toluamide 500μM R08 exp438
0.056
View
BS-181 20μM R08 exp461
0.056
View
ZLN024 50μM R08 exp538
0.055
View
CAY10603 0.55μM R08 exp467
0.054
View
Ethanol 0.01 R05 exp234
0.053
View
CB-839 10μM R05 exp224
0.053
View
Nicotine 3000μM R08 exp510
0.052
View
IU1-47 25μM R04 exp182
0.051
View
Trimetrexate 0.03μM R08 exp535
0.051
View
Rucaparib 6.5μM R08 exp520
0.051
View
×
B02 10μM R08 exp453 vs FTY720 3μM R08 exp483
×
B02 10μM R08 exp453 vs Sulforaphane 9μM R08 exp525
×
B02 10μM R08 exp453 vs Trametinib 10μM R02 exp83
×
B02 10μM R08 exp453 vs Lead acetate 2000μM R08 exp498 no dilution day6
×
B02 10μM R08 exp453 vs NN-Dimethylsphingosine 2.5μM R08 exp508
×
B02 10μM R08 exp453 vs LJH685 50μM R08 exp433
×
B02 10μM R08 exp453 vs Bisphenol F 50μM R08 exp457
×
B02 10μM R08 exp453 vs FK-506 30μM R07 exp359
×
B02 10μM R08 exp453 vs Benzoate 10000μM R08 exp455
×
B02 10μM R08 exp453 vs Ibrutinib 10μM R08 exp442
×
B02 10μM R08 exp453 vs Hydroxychloroquine 30μM R08 exp490
×
B02 10μM R08 exp453 vs Thioridazine 5μM R08 exp530
×
B02 10μM R08 exp453 vs EPZ-5676 30μM R05 exp233
×
B02 10μM R08 exp453 vs Chloroquine 32μM R08 exp470
×
B02 10μM R08 exp453 vs Sulforaphane 9μM R08 exp526 no dilution day6
×
B02 10μM R08 exp453 vs Chlorpromazine 10μM R07 exp344
×
B02 10μM R08 exp453 vs UM0011500 5μM R05 exp245
×
B02 10μM R08 exp453 vs NN-Diethyl-meta-toluamide 500μM R08 exp438
×
B02 10μM R08 exp453 vs BS-181 20μM R08 exp461
×
B02 10μM R08 exp453 vs ZLN024 50μM R08 exp538
×
B02 10μM R08 exp453 vs CAY10603 0.55μM R08 exp467
×
B02 10μM R08 exp453 vs Ethanol 0.01 R05 exp234
×
B02 10μM R08 exp453 vs CB-839 10μM R05 exp224
×
B02 10μM R08 exp453 vs Nicotine 3000μM R08 exp510
×
B02 10μM R08 exp453 vs IU1-47 25μM R04 exp182
×
B02 10μM R08 exp453 vs Trimetrexate 0.03μM R08 exp535
×
B02 10μM R08 exp453 vs Rucaparib 6.5μM R08 exp520
×
Top 30 sensitive GO terms
No GO term hits below threshold. (FDR <0.05)
×
Top 30 resistant GO terms
No GO term hits below threshold. (FDR <0.05)