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Gene Set: D4 : TTD - (beta-CCE)9H-beta-Carboline-3-carboxylic acid


Collection D4 : TTD
Chemical Name (beta-CCE)9H-beta-Carboline-3-carboxylic acid ( From PubChem : 9H-BETA-CARBOLINE-3-CARBOXYLIC ACID )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
212.204 g/mol 2 3 2.4143 True
Structure
InChI InChI=1S/C12H8N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-6,14H,(H,15,16)
InChIKey ARLVFKCLBYUINL-UHFFFAOYSA-N
Links

Gene (8 / 11)


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Source Type Unit Value Gene PMID Assay Other
TTDInhibitorGABRG2Successful target
PubChem AC50_uMuM1.800ARNT-GI(Protien) :
PubChem NoneuMARNT-GI(Protien) :
PubChem PotencyuM3.981BAZ2B-GI(Protien) :
PubChem NoneuMGSTO1-GI(Protien) :
PubChem NoneuMRBBP8-GI(Protien) :
PubChem NoneuMSIX1-GI(Protien) :
PubChem AC50_uMuM1.800TACC3-GI(Protien) :
PubChem NoneuMTACC3-GI(Protien) :
ChEMBLPotencynM3981.100BAZ2B
-Target : CHEMBL1741220
ChEMBLPotencynM7079.500KDM4A
-Target : CHEMBL5896
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