Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D09KUE
|
||||
| Former ID |
DNC013225
|
||||
| Drug Name |
NSC-88915
|
||||
| Drug Type |
Small molecular drug
|
||||
| Indication | Cancer [ICD9: 140-229; ICD10:C00-C96] | Investigative | [529597] | ||
| Structure |
|
Download2D MOL |
|||
| Formula |
C27H33BrO5S
|
||||
| Canonical SMILES |
CC12CCC3C(C1CCC2C(=O)COS(=O)(=O)C4=CC=C(C=C4)Br)CCC5=CC<br />(=O)CCC35C
|
||||
| InChI |
1S/C27H33BrO5S/c1-26-13-11-19(29)15-17(26)3-8-21-22-9-10-24(27(22,2)14-12-23(21)26)25(30)16-33-34(31,32)20-6-4-18(28)5-7-20/h4-7,15,21-24H,3,8-14,16H2,1-2H3/t21-,22-,23-,24+,26-,27-/m0/s1
|
||||
| InChIKey |
ZQNARVKYKGBJES-YNHSGCSHSA-N
|
||||
| PubChem Compound ID | |||||
| Target and Pathway | |||||
| Target(s) | Phosphoribosylaminoimidazolecarboxamide formyltransferase | Target Info | Inhibitor | [527350] | |
| Rhodopsin | Target Info | Inhibitor | [529643] | ||
| Adenylate cyclase | Target Info | Inhibitor | [529597] | ||
| KEGG Pathway | Phototransduction | ||||
| Pathway Interaction Database | Visual signal transduction: Rods | ||||
| References | |||||
| Ref 527350 | J Med Chem. 2004 Dec 30;47(27):6681-90.Virtual screening of human 5-aminoimidazole-4-carboxamide ribonucleotide transformylase against the NCI diversity set by use of AutoDock to identify novel nonfolate inhibitors. | ||||
| Ref 529597 | J Med Chem. 2008 Aug 14;51(15):4456-64. Epub 2008 Jul 17.Structure-based development of novel adenylyl cyclase inhibitors. | ||||
| Ref 529643 | J Med Chem. 2008 Sep 11;51(17):5297-303. Epub 2008 Aug 16.Modulating G-protein coupled receptor/G-protein signal transduction by small molecules suggested by virtual screening. | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.