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10.1208/s12248-014-9621-8 http://scihub22266oqcxt.onion/10.1208/s12248-014-9621-8 24871342/?report=reader!4070249!24871342     free     free     free Deprecated: Implicit conversion from float 217.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 217.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 217.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534       AAPS+J 2014 ; 16 (4): 847-59 Nephropedia Template TP {{tp|p=24871342|t=2014. Many approved drugs have bioactive analogs with different target annotations |pdf=|usr=}}{{24871342}} gab.com Text Many approved drugs have bioactive analogs with different target annotations JO: AAPS J http://www.kidney.de/pget.php?&tw=1&pmid=24871342 #FOAvip Close structural relationships between approved drugs and bioactive compounds were systematically assessed using matched molecular pairs. For structural analogs of drugs, target information was assembled from ChEMBL and compared to drug targets reported in DrugBank. For many drugs, multiple analogs were identified that were active against different targets. Some of these additional targets were closely related to known drug targets while others were not. Surprising discrepancies between reported drug targets and targets of close structural analogs were often observed. On one hand, the results suggest that hypotheses concerning alternative drug targets can often be formulated on the basis of close structural relationships to bioactive compounds that are easily detectable. It is conceivable that such obvious structure-target relationships are frequently not considered (or might be overlooked) when compounds are developed with a focus on a primary target and a few related (or undesired) ones. On the other hand, our findings also raise questions concerning database content and drug repositioning efforts. Twit Text FOAVip Many approved drugs have bioactive analogs with different target annotations ????AAPS J http://www.kidney.de/pget.php?&tw=1&pmid=24871342 #FOAvip Twit Text # Free Paper on # # # # # LINK http://www.kidney.de/pget.php?&tw=1&pmid=24871342 #FOAvip English Wikipedia <ref>{{Cite pmid|24871342}}</ref> Many approved drugs have bioactive analogs with different target annotations #MMPMID24871342 Hu Y; Lounkine E; Bajorath J AAPS J 2014[Jul]; 16 (4): 847-59 PMID24871342show ga Close structural relationships between approved drugs and bioactive compounds were systematically assessed using matched molecular pairs. For structural analogs of drugs, target information was assembled from ChEMBL and compared to drug targets reported in DrugBank. For many drugs, multiple analogs were identified that were active against different targets. Some of these additional targets were closely related to known drug targets while others were not. Surprising discrepancies between reported drug targets and targets of close structural analogs were often observed. On one hand, the results suggest that hypotheses concerning alternative drug targets can often be formulated on the basis of close structural relationships to bioactive compounds that are easily detectable. It is conceivable that such obvious structure-target relationships are frequently not considered (or might be overlooked) when compounds are developed with a focus on a primary target and a few related (or undesired) ones. On the other hand, our findings also raise questions concerning database content and drug repositioning efforts. |Databases, Pharmaceutical/standards/*statistics & numerical data[MESH] |Drug Delivery Systems[MESH] |Drug Repositioning[MESH] |Humans[MESH] |Pharmaceutical Preparations/*chemistry[MESH] |Reproducibility of Results[MESH]Many approved drugs have bioactive analogs with different target annot(epmc).pdf DeepDyve Pubget Overpricing