Tan Lab | DSigDB

Gene Set: D4 : Boss - clonidinum

Collection

D4 : Boss

Chemical Name

clonidinum ( From PubChem : CLONIDINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
230.094 g/mol	2	3	2.2019	True

Structure

InChI

InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)

InChIKey

Links

Gene (19 / 28)

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Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			ACHE
BOSS	Text Mining			ARSA
BOSS	Text Mining			ATP8A2
BOSS	Text Mining			BRD1
BOSS	Text Mining			C7orf49
BOSS	Text Mining			CYP2C8
BOSS	Text Mining			DDR2
BOSS	Text Mining			GCG
BOSS	Text Mining			GGH
BOSS	Text Mining			IGFBP1
BOSS	Text Mining			INS
BOSS	Text Mining			NDOR1
BOSS	Text Mining			POMC
BOSS	Text Mining			SLC25A20
BOSS	Text Mining			TSPAN1
PubChem	Potency	uM	5.012	CYP2C19	-	GI(Protien) :
PubChem	None	uM		CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP2C9	-	GI(Protien) :
PubChem	None	uM		CYP2C9	-	GI(Protien) :
PubChem	Potency	uM	10.000	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
ChEMBL	Activity	-		ADRA2A	-	Target : CHEMBL1867
ChEMBL	Potency	nM	5011.900	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	5011.870	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	7943.280	CYP2C9	-	Target : CHEMBL3397
ChEMBL	Potency	nM	7943.300	CYP2C9	-	Target : CHEMBL3397
ChEMBL	Potency	nM	10000.000	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	10000.000	CYP2D6	-	Target : CHEMBL289

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