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Gene Set: D4 : CTD - tetrachloroisophthalonitrile

Collection D4 : CTD
Chemical Name tetrachloroisophthalonitrile ( From PubChem : CHLOROTHALONIL )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
265.911 g/mol 0 2 4.04356 True
Structure
InChI InChI=1S/C8Cl4N2/c9-5-3(1-13)6(10)8(12)7(11)4(5)2-14
InChIKey CRQQGFGUEAVUIL-UHFFFAOYSA-N
Links

Gene (21 / 45)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDincreases(activity)ERBB2
C005806
CTDincreases(activity)NR1I2
C005806
PubChem Potency-Replicate_1uM1.066AR-GI(Protien) :
PubChem Potency-Replicate_1uM1.087AR-GI(Protien) :
PubChem AR Potency (uM)uM1.151AR-GI(Protien) :
PubChem AR Potency (uM)uM1.422AR-GI(Protien) :
PubChem Potency-Replicate_1uM0.969CYP19A1-GI(Protien) :
PubChem Potency-Replicate_1uM1.506CYP19A1-GI(Protien) :
PubChem PotencyuM3.162CYP3A4-GI(Protien) :
PubChem Potency-Replicate_1uM3.401ESR1-GI(Protien) :
PubChem Ratio Potency (uM)uM10.351ESR1-GI(Protien) :
PubChem Ratio Potency (uM)uM54.954ESR1-GI(Protien) :
PubChem Potency-Replicate_1uM87.076ESR1-GI(Protien) :
PubChem PotencyuM2.512HPGD-GI(Protien) :
PubChem Ratio Potency (uM)uM9.402HSPB1-GI(Protien) :
PubChem Ratio Potency (uM)uM13.031HSPB1-GI(Protien) :
PubChem PotencyuM1.995MAPK1-GI(Protien) :
PubChem PotencyuM2.239MAPK1-GI(Protien) :
PubChem PotencyuM3.981MAPK1-GI(Protien) :
PubChem PotencyuM2.239MAPT-GI(Protien) :
PubChem NoneuMNR1H4-GI(Protien) :
PubChem Potency-Replicate_1uM22.387NR1I2-GI(Protien) :
PubChem PotencyuM1.585POLI-GI(Protien) :
PubChem NoneuMPPARD-GI(Protien) :
PubChem NoneuMPPARG-GI(Protien) :
PubChem PotencyuM7.080RXRA-GI(Protien) :
PubChem PotencyuM0.251SMAD3-GI(Protien) :
PubChem PotencyuM0.025TDP1-GI(Protien) :
PubChem PotencyuM0.178TDP1-GI(Protien) :
PubChem PotencyuM0.517TDP1-GI(Protien) :
PubChem PotencyuM0.651TDP1-GI(Protien) :
PubChem PotencyuM2.512THRB-GI(Protien) :
PubChem PotencyuM3.981TP53-GI(Protien) :
PubChem PotencyuM6.310TP53-GI(Protien) :
PubChem PotencyuM10.000USP1-GI(Protien) :
PubChem PotencyuM0.794VDR-GI(Protien) :
PubChem NoneuMVDR-GI(Protien) :
ChEMBLPotencynM3162.300CYP3A4
-Target : CHEMBL340
ChEMBLPotencynM2511.900HPGD
-Target : CHEMBL1293255
ChEMBLPotencynM1995.300MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM3981.100MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM2238.700MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM2238.700MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM3981.100TP53
-Target : CHEMBL4096
ChEMBLPotencynM6309.600TP53
-Target : CHEMBL4096
Download gene sets gmt, text, Detailed text
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