Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0AH1A
|
|||
| Drug Name |
Benzamide derivative 16
|
|||
| Synonyms |
PMID28627961-Compound-19
Click to Show/Hide
|
|||
| Drug Type |
Small molecular drug
|
|||
| Company |
BOEHRINGER INGELHEIM INTERNATIONAL GMBH PRIEPKE, Henning DOODS, Henri KUELZER, Raimund PFAU, Roland STENKAMP, Dirk ROENN, Robert PELCMAN, Benjamin
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C29H20BrCl2F2N3O4
|
|||
| Canonical SMILES |
COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)CNC(=O)C3=C(C=CC(=C3Cl)F)F)Cl)C(=O)NC4=CC=C(C=C4)Br
|
|||
| InChI |
1S/C29H20BrCl2F2N3O4/c1-41-24-11-7-18(13-20(24)28(39)36-17-5-3-16(30)4-6-17)37-27(38)19-12-15(2-8-21(19)31)14-35-29(40)25-22(33)9-10-23(34)26(25)32/h2-13H,14H2,1H3,(H,35,40)(H,36,39)(H,37,38)
|
|||
| InChIKey |
OKMLKFQCNOUSOP-UHFFFAOYSA-N
|
|||
| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Prostaglandin E synthase (PTGES) | Target Info | Inhibitor | [1] |
| Target's Patent Info | Prostaglandin E synthase (PTGES) | Target's Patent Info | [1] | |
| BioCyc | C20 prostanoid biosynthesis | |||
| KEGG Pathway | Arachidonic acid metabolism | |||
| Metabolic pathways | ||||
| NetPath Pathway | IL1 Signaling Pathway | |||
| TCR Signaling Pathway | ||||
| Pathwhiz Pathway | Arachidonic Acid Metabolism | |||
| WikiPathways | Arachidonic acid metabolism | |||
| Eicosanoid Synthesis | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Microsomal prostaglandin E2 synthase-1 inhibitors: a patent review.Expert Opin Ther Pat. 2017 Sep;27(9):1047-1059. | |||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.