Tan Lab | DSigDB

Gene Set: D4 : TTD - Cilnidipine

Collection

D4 : TTD

Chemical Name

Cilnidipine ( From PubChem : CILNIDIPINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
492.52 g/mol	1	6	5.1278	False(3/4)

Structure

InChI

InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+/t25-/m1/s1

InChIKey

KJEBULYHNRNJTE-FPVCCHAOSA-N

Links

Gene (10 / 19)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Multitarget			CACNA1B		Successful target
TTD	Drug(s)			CACNA1B		Successful target
TTD	Blocker			CACNA1B		Successful target
PubChem	Potency-Replicate_1	uM	0.944	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	0.944	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.314	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.603	AR	-	GI(Protien) :
PubChem	AR Potency (uM)	uM	26.603	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.915	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	26.832	ESR1	-	GI(Protien) :
PubChem	Potency	uM	29.855	GMNN	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	10.590	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	7.497	NR1H4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	9.438	NR1H4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	10.682	NR3C1	-	GI(Protien) :
PubChem	None	uM		NR3C1	-	GI(Protien) :
PubChem	Potency	uM	5.173	PARK2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	18.832	PPARG	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :

Download gene sets

gmt, text, Detailed text