Therapeutic Targets Database
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TTD Drug ID: DNC004375

Drug Information
NameSOMATOSTATIN
SynonymsSOMATOSTATIN
IndicationNot AvailableExperimental    
Structure

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InChI1S/C76H104N18O19S2/c1-41(79)64(100)82-37-61(99)83-58-39-114-115-4
0-59(76(112)113)92-72(108)57(38-95)91-75(111)63(43(3)97)94-71(107
)54(33-46-23-11-6-12-24-46)90-74(110)62(42(2)96)93-66(102)51(28-1
6-18-30-78)84-69(105)55(34-47-36-81-49-26-14-13-25-48(47)49)88-68
(104)53(32-45-21-9-5-10-22-45)86-67(103)52(31-44-19-7-4-8-20-44)8
7-70(106)56(35-60(80)98)89-65(101)50(85-73(58)109)27-15-17-29-77/
h4-14,19-26,36,41-43,50-59,62-63,81,95-97H,15-18,27-35,37-40,77-7
9H2,1-3H3,(H2,80,98)(H,82,100)(H,83,99)(H,84,105)(H,85,109)(H,86,
103)(H,87,106)(H,88,104)(H,89,101)(H,90,110)(H,91,111)(H,92,108)(
H,93,102)(H,94,107)(H,112,113)/t41-,42+,43+,50-,51-,52-,53-,54-,5
5-,56-,57-,58-,59-,62-,63-/m0/s1
InChIKeyNHXLMOGPVYXJNR-ATOGVRKGSA-N
Canonical SMILESCC(C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)
NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)CC5=CC=
CC=C5)CC(=O)N)CCCCN)NC(=O)CNC(=O)C(C)N)C(=O)O)CO)C(C)O)CC6=CC=CC=C6)O    
Isomeric SMILESC[C@H]([C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H]
(C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]
(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)CC5=CC=CC=C5)CC(=O)N)
CCCCN)NC(=O)CNC(=O)[C@H](C)N)C(=O)O)CO)[C@@H](C)O)CC6=CC=CC=C6)O
SuperDrug ATC IDH01CB01
TargetDelta opioid receptorInhibitor[1]
Mu opioid receptorInhibitor[1]
Somatostatin receptor 1Inhibitor[2]
Somatostatin receptor 2Inhibitor[2]
Somatostatin receptor 3Inhibitor[2]
Somatostatin receptor 4Inhibitor[2]
Somatostatin receptor 5Inhibitor[2]
Ref 1J Med Chem. 1986 Nov;29(11):2370-5.Design and synthesis of conformationally constrained somatostatin analogues with high potency and specificity for mu opioid receptors. To Reference
Ref 2J Med Chem. 2005 Oct 20;48(21):6643-52.Discovery of iodinated somatostatin analogues selective for hsst2 and hsst5 with excellent inhibition of growth hormone and prolactin release from rat pituitary cells. To Reference



 

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