Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
DX0UIJ
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| Drug Name |
2-[2-(Morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-pent-4-enoic acid [1-cyclohexylmethyl-3,3-difluoro-3-(2-morpholin-4-yl-ethylcarbamoyl)-2-oxo-propyl]-amide
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| Synonyms |
CHEMBL287423
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C35H52F2N6O8S
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| Canonical SMILES |
FC(F)(C(=O)NCCN1CCOCC1)C(=O)[C@H](CC2CCCCC2)NC(=O)[C@H](CC=C)NC(=O)[C@H](Cc3ccccc3)NS(=O)(=O)N4CCOCC4
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| InChI |
InChI=1S/C35H52F2N6O8S/c1-2-9-28(39-33(46)30(25-27-12-7-4-8-13-27)41-52(48,49)43-18-22-51-23-19-43)32(45)40-29(24-26-10-5-3-6-11-26)31(44)35(36,37)34(47)38-14-15-42-16-20-50-21-17-42/h2,4,7-8,12-13,26,28-30,41H,1,3,5-6,9-11,14-25H2,(H,38,47)(H,39,46)(H,40,45)/t28-,29-,30-/m0/s1
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| InChIKey |
MQDDTALXSBQTQP-DTXPUJKBSA-N
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| Target and Pathway | |||||
| Target(s) | Renin, renal | Target Info | [1587926] | ||
| Cathepsin D | Target Info | [1587926] | |||
| BioCyc Pathway | Thyroid hormone biosynthesis | ||||
| NetPath Pathway | IL2 Signaling Pathway | ||||
| Pathway Interaction Database | LKB1 signaling events | ||||
| Ceramide signaling pathway | |||||
| Direct p53 effectors | |||||
| Validated nuclear estrogen receptor alpha network | |||||
| PathWhiz Pathway | Angiotensin Metabolism | ||||
| References | |||||
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