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Gene Set: D4 : CTD - Rose Bengal


Collection D4 : CTD
Chemical Name Rose Bengal ( From PubChem : ROSE BENGALE )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
ApprovedNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
1049.85 g/mol 0 5 8.1041 False(2/4)
Structure
InChI InChI=1S/C20H4Cl4I4O5.2K/c21-10-8(9(20(31)32)11(22)13(24)12(10)23)7-3-1-5(25)16(29)14(27)18(3)33-19-4(7)2-6(26)17(30)15(19)28;;/h1-2,29H,(H,31,32);;/q;2*+1/p-2
InChIKey AZJPTIGZZTZIDR-UHFFFAOYSA-L
Links

Gene (17 / 27)


⊖ Less

Source Type Unit Value Gene PMID Assay Other
CTDdecreases(activity)ABCB1
D012395
CTDdecreases(activity)CYP3A4
D012395
CTDdecreases(activity)IYD
D012395
CTDdecreases(activity)UGT1A6
D012395
PubChem AhR Potency (uM)uM5.011AHR-GI(Protien) :
PubChem Potency-Replicate_1uM6.682AHR-GI(Protien) :
PubChem Potency-Replicate_1uM13.333AR-GI(Protien) :
PubChem Potency-Replicate_1uM8.485NR3C1-GI(Protien) :
PubChem Ratio Potency (uM)uM13.448NR3C1-GI(Protien) :
PubChem PotencyuM14.963TDP1-GI(Protien) :
ChEMBLPotencynM31622.800ALDH1A1
-Target : CHEMBL3577
ChEMBLPotencynM7943.300ALOX15B
-Target : CHEMBL2457
ChEMBLPotencynM11220.200BLM
-Target : CHEMBL1293237
ChEMBLPotencynM14125.400BLM
-Target : CHEMBL1293237
ChEMBLPotencynM1778.300EHMT2
-Target : CHEMBL6032
ChEMBLPotencynM31622.800HPGD
-Target : CHEMBL1293255
ChEMBLPotencynM3548.100KAT2A
-Target : CHEMBL5501
ChEMBLPotencynM1995.300KAT2A
-Target : CHEMBL5501
ChEMBLPotencynM1584.900MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM3162.300MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM28183.800RECQL
-Target : CHEMBL1293236
ChEMBLPotencynM44668.400RECQL
-Target : CHEMBL1293236
ChEMBLPotencynM14125.400RECQL
-Target : CHEMBL1293236
ChEMBLPotencynM6309.600THRB
-Target : CHEMBL1947
ChEMBLPotencynM3981.100THRB
-Target : CHEMBL1947
ChEMBLPotencynM5011.900THRB
-Target : CHEMBL1947
ChEMBLPotencynM2818.400THRB
-Target : CHEMBL1947
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