Tan Lab | DSigDB

Gene Set: D1 - Approved - TIMOLOL

Collection

D1 : Approved

Chemical Name

TIMOLOL

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
316.42 g/mol	2	8	0.9584	True

Structure

InChI

InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3/t10-/m0/s1

InChIKey

BLJRIMJGRPQVNF-JTQLQIEISA-N

Links

Gene (4 / 14)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
PubChem	IC50	uM	0.003	ADRB1	-	GI(Protien) :
PubChem		uM		ADRB1	-	GI(Protien) :
PubChem	IC50	uM	0.000	ADRB2	-	GI(Protien) :
PubChem		uM		ADRB2	-	GI(Protien) :
PubChem	IC50	uM	0.452	ADRB3	-	GI(Protien) :
PubChem	IC50	uM	11.000	CYP2D6		GI(Protien) :
PubChem	Potency	uM	12.589	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	31.623	CYP2D6	-	GI(Protien) :
PubChem		uM		CYP2D6	-	GI(Protien) :
ChEMBL	Selectivity	-		ADRB1	-	Target : CHEMBL213
ChEMBL	Potency	nM	12589.300	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	31622.800	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	12589.200	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	31622.800	CYP2D6	-	Target : CHEMBL289

Download gene sets

gmt, text, Detailed text

Contact us
Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA

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