Drug Information
Drug General Information | |||||
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Drug ID |
D08VEJ
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Former ID |
DNC004133
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Drug Name |
IODOMELATONIN
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Drug Type |
Small molecular drug
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Indication | Discovery agent | Investigative | [526317] | ||
Structure |
Download2D MOL |
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Formula |
C13H15IN2O2
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Canonical SMILES |
CC(=O)NCCC1=C(NC2=C1C=C(C=C2)OC)I
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InChI |
1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)
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InChIKey |
FJDDSMSDZHURBJ-UHFFFAOYSA-N
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PubChem Compound ID | |||||
Target and Pathway | |||||
Target(s) | Melatonin receptor | Target Info | Inhibitor | [526317] | |
Melatonin receptor type 1B | Target Info | Inhibitor | [526317] | ||
NRH dehydrogenase [quinone] 2 | Target Info | Inhibitor | [529999] | ||
References | |||||
Ref 526317 | J Med Chem. 2002 Apr 25;45(9):1853-9.Synthesis of nitroindole derivatives with high affinity and selectivity for melatoninergic binding sites MT(3). | ||||
Ref 529999 | J Med Chem. 2009 Apr 9;52(7):1873-84.Synthesis of casimiroin and optimization of its quinone reductase 2 and aromatase inhibitory activities. |
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