Tan Lab | DSigDB

Gene Set: D4 : CTD - chlorobenzilate

Collection

D4 : CTD

Chemical Name

chlorobenzilate ( From PubChem : CHLOROBENZILATE )

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
325.187 g/mol	1	3	3.7924	True

Structure

InChI

InChI=1S/C16H14Cl2O3/c1-2-21-15(19)16(20,11-3-7-13(17)8-4-11)12-5-9-14(18)10-6-12/h3-10,20H,2H2,1H3

InChIKey

Links

Gene (6 / 19)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(reaction)			AR		C004659
CTD	increases(activity)			AR		C004659
CTD	decreases(reaction)			AR		C004659
CTD	increases(activity)			AR		C004659
CTD	increases(activity)			ESR1		C004659
CTD	affects(binding)			NR1I2		C004659
CTD	increases(activity)			NR1I2		C004659
PubChem	Potency-Replicate_1	uM	24.584	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	61.131	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	19.494	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	19.528	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	68.590	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	4.372	CYP19A1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	30.638	CYP19A1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	46.697	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	54.941	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	55.499	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	57.090	ESR1	-	GI(Protien) :
PubChem	None	uM		NR3C1	-	GI(Protien) :

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