DSigDB

Drug SIGnatures DataBase Collection of Annoated Drug / Compound Gene Sets

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Gene Set: D4 : TTD - 1-Cyclohexyl-3-phenethyl-urea

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Collection	D4 : TTD
Chemical Name	1-Cyclohexyl-3-phenethyl-urea ( From PubChem : CHEMBL193888 )
FDA NPC WHO Indian Australia China Traditional Herbal Clinical Trail Not Not Not Not Not Not Not Not
Molecular Weight Hydrogen Bond Donor Count Hydrogen Bond Acceptor Count cLogP Lipinski Rule 246.348 g/mol 2 3 3.6428 True
Structure
InChI	InChI=1S/C15H22N2O/c18-15(17-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H2,16,17,18)
InChIKey	YJAMPQZPTKVFIU-UHFFFAOYSA-N
Links
Gene (12 / 16) ⊖ Less	Source Type Unit Value Gene PMID Assay Other TTD Inhibitor EPHX2 Clinical trial target PubChem None uM CYP2C19 - GI(Protien) : PubChem None uM EPHX2 - GI(Protien) : PubChem None uM INS - GI(Protien) : PubChem None uM MRGPRX1 - GI(Protien) : PubChem None uM NFKB1 - GI(Protien) : PubChem Potency uM 1.122 NPC1 - GI(Protien) : PubChem None uM OXTR - GI(Protien) : PubChem Potency uM 0.562 RAB9A - GI(Protien) : PubChem None uM RELA - GI(Protien) : PubChem None uM SMARCA2 - GI(Protien) : PubChem None uM SMARCA2 - GI(Protien) : PubChem Potency uM 11.220 SMN2 - GI(Protien) : ChEMBL Potency nM 1122.000 NPC1 - Target : CHEMBL1293277 ChEMBL Potency nM 562.300 RAB9A - Target : CHEMBL1293294 ChEMBL Potency nM 11220.200 SMN1; SMN2 - Target : CHEMBL1293232
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