Tan Lab | DSigDB

Gene Set: D4 : TTD - Suramin

Collection

D4 : TTD

Chemical Name

Suramin ( From PubChem : SURAMIN )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
1297.28 g/mol	12	29	13.666	False(0/4)

Structure

InChI

InChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)

InChIKey

FIAFUQMPZJWCLV-UHFFFAOYSA-N

Links

Gene (18 / 25)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Antagonist			FSHR		Successful target
TTD	Drug(s)			FSHR		Successful target
PubChem	Potency	uM	1.413	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	8.912	GLS	-	GI(Protien) :
PubChem	Potency	uM	14.125	KMT2A	-	GI(Protien) :
PubChem	Potency	uM	0.032	POLK	-	GI(Protien) :
PubChem	Potency	uM	7.943	USP1	-	GI(Protien) :
PubChem	Potency	uM	35.481	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	1995.300	CBX1	-	Target : CHEMBL1741193
ChEMBL	Potency	nM	1412.500	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	281.800	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	335.900	FEN1	-	Target : CHEMBL5027
ChEMBL	Potency	nM	7943.300	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	14125.400	KMT2A	-	Target : CHEMBL1293299
ChEMBL	Potency	nM	1888.800	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	425.600	PIN1	-	Target : CHEMBL2288
ChEMBL	Potency	nM	2511.900	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	19952.600	RECQL	-	Target : CHEMBL1293236
ChEMBL	Inhibition	-		SIRT1	-	Target : CHEMBL4506
ChEMBL	Inhibition	-		SIRT3	-	Target : CHEMBL4461
ChEMBL	Inhibition	-		SIRT5	-	Target : CHEMBL2163183
ChEMBL	Potency	nM	11220.200	TDP1	-	Target : CHEMBL1075138
ChEMBL	Potency	nM	4466.800	TDP1	-	Target : CHEMBL1075138
ChEMBL	Potency	nM	2511.900	TDP1	-	Target : CHEMBL1075138
ChEMBL	Potency	nM	3288.500	USP2	-	Target : CHEMBL1293227

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