Tan Lab | DSigDB

Gene Set: D4 : TTD - [HO1][Orn8(5/6C-Rhm)]VT

Collection

D4 : TTD

Chemical Name

[HO1][Orn8(5/6C-Rhm)]VT ( From PubChem : CHEMBL406521 )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
1382.58 g/mol	14	31	3.6544	False(1/4)

Structure

InChI

InChI=1S/C65H84N14O16S2/c1-7-33(2)54-62(90)72-44(22-23-51(67)82)58(86)73-45(29-52(68)83)59(87)74-46(30-96-97-31-48(81)61(89)76-55(63(91)75-54)34-12-17-38(80)18-13-34)64(92)79-25-9-11-47(79)60(88)71-43(57(85)70-32-66)10-8-24-69-56(84)35-14-19-39(42(26-35)65(93)94)53-40-20-15-36(77(3)4)27-49(40)95-50-28-37(78(5)6)16-21-41(50)53/h12-21,26-28,33,40,43-48,50,54-55,81H,7-11,22-25,29-32,66H2,1-6H3,(H13-,67,68,69,70,71,72,73,74,75,76,80,82,83,84,85,86,87,88,89,90,91,93,94)/p+1/t33?,40?,43-,44+,45+,46+,47+,48?,50?,54+,55-/m0/s1

InChIKey

XSTBAVMTSHGRBE-CEBVGXOVSA-O

Links

Gene (2 / 2)

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Source	Type	Unit	Value	Gene	PMID	Assay	Other
TTD	Inhibitor			AVPR1A			Successful target
TTD	Inhibitor			OXTR			Successful target

Download gene sets

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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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