Tan Lab | DSigDB

Gene Set: D4 : CTD - triclocarban

Collection

D4 : CTD

Chemical Name

triclocarban ( From PubChem : TRICLOCARBAN )

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Not	Approved	Not	Not	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
315.582 g/mol	2	3	5.4368	False(3/4)

Structure

InChI

InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)

InChIKey

ICUTUKXCWQYESQ-UHFFFAOYSA-N

Links

Gene (29 / 90)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(cotreatment)			AHR		C009540
CTD	decreases(reaction)			AHR		C009540
CTD	increases(expression)			AHR		C009540
CTD	increases(activity)			AR		C009540
CTD	increases(reaction)			AR		C009540
CTD	affects(binding)			AR		C009540
CTD	increases(activity)			AR		C009540
CTD	increases(reaction)			AR		C009540
CTD	increases(activity)			AR		C009540
CTD	increases(reaction)			AR		C009540
CTD	affects(cotreatment)			CYP1A1		C009540
CTD	decreases(reaction)			CYP1A1		C009540
CTD	increases(expression)			CYP1A1		C009540
CTD	increases(activity)			CYP1A1		C009540
CTD	affects(reaction)			CYP1B1		C009540
CTD	increases(expression)			CYP1B1		C009540
CTD	increases(expression)			CYP1B1		C009540
CTD	increases(reaction)			CYP1B1		C009540
CTD	affects(reaction)			CYP2B6		C009540
CTD	increases(expression)			CYP2B6		C009540
CTD	affects(cotreatment)			ESR1		C009540
CTD	decreases(reaction)			ESR1		C009540
CTD	increases(expression)			ESR1		C009540
CTD	affects(reaction)			ESR1		C009540
CTD	increases(expression)			ESR1		C009540
CTD	increases(activity)			ESR1		C009540
CTD	increases(reaction)			ESR1		C009540
CTD	decreases(reaction)			NR1I3		C009540
CTD	increases(expression)			NR1I3		C009540
CTD	decreases(reaction)			UGT1A1		C009540
CTD	increases(expression)			UGT1A1		C009540
CTD	decreases(reaction)			UGT1A3		C009540
CTD	increases(expression)			UGT1A3		C009540
CTD	decreases(reaction)			UGT1A4		C009540
CTD	increases(expression)			UGT1A4		C009540
CTD	decreases(reaction)			UGT1A6		C009540
CTD	increases(expression)			UGT1A6		C009540
CTD	decreases(reaction)			UGT1A9		C009540
CTD	increases(expression)			UGT1A9		C009540
PubChem	Potency-Replicate_1	uM	2.158	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	2.434	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	2.516	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	2.731	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	4.216	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	4.364	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	6.007	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	13.685	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	43.057	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	9.639	CYP19A1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	13.685	CYP19A1	-	GI(Protien) :
PubChem	None	uM		DRD1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	0.977	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	3.466	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	11.436	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	13.333	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	24.213	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	27.167	ESR1	-	GI(Protien) :
PubChem	None	uM		HCRTR1	-	GI(Protien) :
PubChem	None	uM		HCRTR1	-	GI(Protien) :
PubChem	Potency	uM	11.220	HTT	-	GI(Protien) :
PubChem	None	uM		IL1B	-	GI(Protien) :
PubChem	None	uM		MDM2	-	GI(Protien) :
PubChem	None	uM		MDM2	-	GI(Protien) :
PubChem	None	uM		MDM4	-	GI(Protien) :
PubChem	None	uM		MDM4	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	1.790	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	2.158	NFE2L2	-	GI(Protien) :
PubChem	IC50_Mean	uM	0.805	NLRP3	-	GI(Protien) :
PubChem	IC50_Mean	uM	1.490	NLRP3	-	GI(Protien) :
PubChem	None	uM		NLRP3	-	GI(Protien) :
PubChem	None	uM		NLRP3	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	19.406	PPARD	-	GI(Protien) :
PubChem	Potency	uM	10.000	RXRA	-	GI(Protien) :
PubChem	Potency	uM	3.162	SMAD3	-	GI(Protien) :
PubChem	Potency	uM	5.173	SMAD3	-	GI(Protien) :
PubChem	None	uM		TAAR1	-	GI(Protien) :
PubChem	Potency	uM	0.841	TDP1	-	GI(Protien) :
PubChem	Potency	uM	1.189	TDP1	-	GI(Protien) :
PubChem	Potency	uM	2.512	TDP1	-	GI(Protien) :
PubChem	Potency	uM	2.909	TDP1	-	GI(Protien) :
PubChem	Potency	uM	4.611	TDP1	-	GI(Protien) :
PubChem	Potency	uM	5.012	TDP1	-	GI(Protien) :
PubChem	None	uM		TRA	-	GI(Protien) :
PubChem	None	uM		TRA	-	GI(Protien) :
PubChem	None	uM		TSHR		GI(Protien) :
PubChem	None	uM		TSHR		GI(Protien) :
ChEMBL	Potency	nM	11220.200	HTT	-	Target : CHEMBL5514
ChEMBL	IC50	nM	805.000	NLRP3	-	Target : CHEMBL1741208
ChEMBL	IC50	nM	1490.000	NLRP3	-	Target : CHEMBL1741208
ChEMBL	Potency	nM	28183.800	TP53	-	Target : CHEMBL4096

Download gene sets

gmt, text, Detailed text