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Gene Set: D1 - Approved - CRYSTAL VIOLET


Collection D1 : Approved
Chemical Name CRYSTAL VIOLET
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
ApprovedNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
407.979 g/mol 0 2 1.4636 True
Structure
InChI InChI=1S/C25H30N3.ClH/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6;/h7-18H,1-6H3;1H/q+1;/p-1
InChIKey ZXJXZNDDNMQXFV-UHFFFAOYSA-M
Links

Gene (48 / 111)


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Source Type Unit Value Gene PMID Assay Other
PubChem IC50uM5.847ACHE-GI(Protien) :
PubChem IC50uM3.365ADORA2A-GI(Protien) :
PubChem IC50uM4.166ADORA3-GI(Protien) :
PubChem IC50uM1.980ADRA1D-GI(Protien) :
PubChem IC50uM0.536ADRA2A-GI(Protien) :
PubChem IC50uM1.258ADRA2B-GI(Protien) :
PubChem IC50uM1.884ADRA2C-GI(Protien) :
PubChem PotencyuM2.421AHR-GI(Protien) :
PubChem AhR Potency (uM)uM2.731AHR-GI(Protien) :
PubChem Ratio Potency (uM)uM0.290AR-GI(Protien) :
PubChem PotencyuM0.347AR-GI(Protien) :
PubChem PotencyuM0.859AR-GI(Protien) :
PubChem PotencyuM0.864AR-GI(Protien) :
PubChem AR Potency (uM)uM1.267AR-GI(Protien) :
PubChem AR Potency (uM)uM1.470AR-GI(Protien) :
PubChem PotencyuM2.371AR-GI(Protien) :
PubChem Ratio Potency (uM)uM29.167AR-GI(Protien) :
PubChem Ratio Potency (uM)uMAR-GI(Protien) :
PubChem PotencyuM22.387BLM-GI(Protien) :
PubChem IC50uM1.095CHRM1-GI(Protien) :
PubChem IC50uM1.430CHRM2-GI(Protien) :
PubChem IC50uM4.330CHRM3-GI(Protien) :
PubChem IC50uM1.005CHRM4-GI(Protien) :
PubChem IC50uM0.535CHRM5-GI(Protien) :
PubChem PotencyuM0.608CYP19A1-GI(Protien) :
PubChem PotencyuM0.864CYP19A1-GI(Protien) :
PubChem PotencyuM2.985CYP19A1-GI(Protien) :
PubChem uMCYP19A1-GI(Protien) :
PubChem IC50uM0.824CYP2D6-GI(Protien) :
PubChem IC50uM3.634CYP3A4-GI(Protien) :
PubChem PotencyuM10.000CYP3A4-GI(Protien) :
PubChem IC50uM3.102DRD1-GI(Protien) :
PubChem IC50uM3.178DRD2-GI(Protien) :
PubChem IC50uM0.831DRD3-GI(Protien) :
PubChem IC50uM0.473EGFR-GI(Protien) :
PubChem Ratio Potency (uM)uM0.297ESR1-GI(Protien) :
PubChem PotencyuM2.421ESR1-GI(Protien) :
PubChem ER Potency (uM)uM2.878ESR1-GI(Protien) :
PubChem PotencyuM3.075ESR1-GI(Protien) :
PubChem ER Potency (uM)uM3.184ESR1-GI(Protien) :
PubChem PotencyuM3.857ESR1-GI(Protien) :
PubChem Ratio Potency (uM)uM6.885ESR1-GI(Protien) :
PubChem PotencyuM28.184ESR1-GI(Protien) :
PubChem PotencyuM34.665ESR1-GI(Protien) :
PubChem IC50uM2.148FYN-GI(Protien) :
PubChem uMGAPDH-GI(Protien) :
PubChem PotencyuM3.162GBA-GI(Protien) :
PubChem IC50uM1.155HRH2-GI(Protien) :
PubChem Ratio Potency (uM)uM5.494HSPB1-GI(Protien) :
PubChem Ratio Potency (uM)uM12.586HSPB1-GI(Protien) :
PubChem Ratio Potency (uM)uM13.218HSPB1-GI(Protien) :
PubChem IC50uM2.627HTR2A-GI(Protien) :
PubChem PotencyuM12.589KCNH2GI(Protien) :
PubChem PotencyuM12.589KCNH2GI(Protien) :
PubChem PotencyuM1.995MAPK1-GI(Protien) :
PubChem PotencyuM10.000MAPK1-GI(Protien) :
PubChem PotencyuM12.589MAPK1-GI(Protien) :
PubChem PotencyuM0.180MAPT-GI(Protien) :
PubChem 2nd Test ConcentrationuM0.720MAPT-GI(Protien) :
PubChem PotencyuM5.012MAPT-GI(Protien) :
PubChem PotencyuM15.849MAPT-GI(Protien) :
PubChem uMMAPT-GI(Protien) :
PubChem Ratio Potency (uM)uM2.009NFE2L2-GI(Protien) :
PubChem PotencyuM16.784NR1H4-GI(Protien) :
PubChem IC50uM1.540OPRK1-GI(Protien) :
PubChem IC50uM2.145OPRM1-GI(Protien) :
PubChem Ratio Potency (uM)uM8.485PPARG-GI(Protien) :
PubChem PotencyuM8.485PPARG-GI(Protien) :
PubChem Ratio Potency (uM)uM10.910PPARG-GI(Protien) :
PubChem Ratio Potency (uM)uM10.962PPARG-GI(Protien) :
PubChem PotencyuM44.668PPARG-GI(Protien) :
PubChem PotencyuM2.371RORC-GI(Protien) :
PubChem IC50uM4.069SLC6A3-GI(Protien) :
PubChem PotencyuM0.151SNCA-GI(Protien) :
PubChem IC50uM1.679TACR2-GI(Protien) :
PubChem PotencyuM0.231TDP1-GI(Protien) :
PubChem PotencyuM0.266TDP1-GI(Protien) :
PubChem PotencyuM0.266TDP1-GI(Protien) :
PubChem PotencyuM0.517TDP1-GI(Protien) :
PubChem PotencyuM28.184THRB-GI(Protien) :
PubChem PotencyuM100.000THRB-GI(Protien) :
PubChem PotencyuM19.953USP1-GI(Protien) :
PubChem PotencyuM22.387USP1-GI(Protien) :
PubChem PotencyuM10.000USP2-GI(Protien) :
PubChem PotencyuM31.623VDR-GI(Protien) :
PubChem PotencyuM39.811VDR-GI(Protien) :
ChEMBLPotencynM150.000APP
-Target : CHEMBL2487
ChEMBLPotencynM22387.200BLM
-Target : CHEMBL1293237
ChEMBLPotencynM10000.000CYP3A4
-Target : CHEMBL340
ChEMBLPotencynM28183.800ESR1
-Target : CHEMBL206
ChEMBLPotencynM3162.300GBA
-Target : CHEMBL2179
ChEMBLPotencynM12589.300KCNH2
-Target : CHEMBL240
ChEMBLPotencynM1995.300MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM12589.300MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM10000.000MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM5011.900MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM7079.500MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM180.000MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM15848.900MAPT
-Target : CHEMBL1293224
ChEMBLPotencynM44668.400PPARG
-Target : CHEMBL235
ChEMBLPotencynM10000.000RECQL
-Target : CHEMBL1293236
ChEMBLPotencynM35481.300RECQL
-Target : CHEMBL1293236
ChEMBLPotencynM2371.000RORC
-Target : CHEMBL1741186
ChEMBLPotencynM151.460SNCA
-Target : CHEMBL6152
ChEMBLPotencynM100000.000THRB
-Target : CHEMBL1947
ChEMBLPotencynM28183.800THRB
-Target : CHEMBL1947
ChEMBLPotencynM19952.600USP1
-Target : CHEMBL1795087
ChEMBLPotencynM22387.200USP1
-Target : CHEMBL1795087
ChEMBLPotencynM10000.000USP2
-Target : CHEMBL1293227
ChEMBLPotencynM31622.800VDR
-Target : CHEMBL1977
ChEMBLPotencynM39810.700VDR
-Target : CHEMBL1977
Download gene sets gmt, text, Detailed text
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