Tan Lab | DSigDB

Gene Set: D1 - Approved - SIROLIMUS

Collection

D1 : Approved

Chemical Name

SIROLIMUS

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
914.172 g/mol	3	14	6.1185	False(1/4)

Structure

InChI

InChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12-,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38?,39?,40-,42+,43?,44-,46-,47+,51-/m1/s1

InChIKey

QFJCIRLUMZQUOT-MQTWOLQFSA-N

Links

Gene (11 / 29)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
PubChem	Ratio Potency (uM)	uM	9.893	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	10.682	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.132	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.710	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.832	AR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	26.832	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	2.113	CYP19A1	-	GI(Protien) :
PubChem		uM		CYP19A1	-	GI(Protien) :
PubChem	IC50	uM	4.000	CYP2C19	-	GI(Protien) :
PubChem	IC50	uM	2.000	CYP2C9	-	GI(Protien) :
PubChem	IC50	uM	2.000	CYP3A4	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	0.003	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.004	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	0.005	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.007	ESR1	-	GI(Protien) :
PubChem		uM		FKBP1A	-	GI(Protien) :
PubChem	Ki	uM	0.003	FKBP5		GI(Protien) :
PubChem	IC50	uM	0.000	MTOR		GI(Protien) :
PubChem	IC50	uM	0.002	MTOR		GI(Protien) :
PubChem	IC50	uM	0.010	MTOR		GI(Protien) :
PubChem		uM		MTOR		GI(Protien) :
PubChem		uM		MTOR		GI(Protien) :
PubChem	Potency-Replicate_1	uM	16.930	NR3C1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	23.915	NR3C1	-	GI(Protien) :
PubChem	Potency	uM	0.002	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.005	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.008	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.012	TDP1	-	GI(Protien) :
PubChem	Potency	uM	4.467	TDP1	-	GI(Protien) :

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