Target
Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific)
Ligand
BDBM50533424
Substrate
n/a
Meas. Tech.
ChEMBL_1925559 (CHEMBL4428631)
IC50
>100000±n/a nM
Citation
 Concha, NHuang, JBai, XBenowitz, ABrady, PGrady, LCKryn, LHHolmes, DIngraham, KJin, QPothier Kaushansky, LMcCloskey, LMesser, JAO'Keefe, HPatel, ASatz, ALSinnamon, RHSchneck, JSkinner, SRSummerfield, JTaylor, ATaylor, JDEvindar, GStavenger, RA Discovery and Characterization of a Class of Pyrazole Inhibitors of Bacterial Undecaprenyl Pyrophosphate Synthase. J Med Chem 59:7299-304 (2016) [PubMed]  Article 
Target
Name:
Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific)
Synonyms:
2.5.1.31 | B6R99_22675 | BL124_00006685 | BVX91_05050 | C2U49_24455 | C3F39_10000 | C4Y50_020825 | C7V41_15310 | CK508_014895 | DD581_11340 | DD583_02800 | DM059_01770 | DM060_02180 | DM062_01640 | DM078_21385 | DN589_11125 | Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific) | Ditrans,polycis-undecaprenylcistransferase | EAO17_18750 | EPB11_21735 | EXT45_14130 | F0330_15630 | F1D54_14375 | F3G17_17315 | F3G25_13635 | FAT93_12920 | FCH06_004790 | FKC87_03665 | FXN60_15260 | FXN67_19200 | GF489_21370 | GJJ01_07540 | GS419_22180 | SAMEA104567846_04352 | SAMEA104567906_04153 | SAMEA3531867_03978 | SAMEA3673122_01824 | SAMEA3727630_03610 | SAMEA4873632_03687 | Synonyms=uppS {ECO:0000256|HAMAP-Rule:MF_01139 | UDS | UPP synthase | Undecaprenyl diphosphate synthase | Undecaprenyl pyrophosphate synthase | ispU
Type:
PROTEIN
Mol. Mass.:
28215.16
Organism:
Klebsiella pneumoniae
Description:
ChEMBL_119653
Residue:
252
Sequence:
MLSANQTVSEISPTHGCRHVAIIMDGNGRWAKRQGKIRAFGHKAGAKSVRRAVSFAANNGIEALTLYAFSSENWNRPAQEVSALMELFVWALDSEVKSLHRHNVRLRIIGDTTRFNARLQERIRKAEALTANNTGLTLNIAANYGGRWDITQGVRLLAKQVQDGTLLPEQITEDMLSQQVCMHELAPVDLVIRTGGEHRISNFLIWQIAYAELYFTDVLWPDFAEQDFEGALHAFVNRERRFGGTEPGGSHA
  
Inhibitor
Name:
BDBM50533424
Synonyms:
CHEMBL4574148
Type:
Small organic molecule
Emp. Form.:
C32H32N4O3S
Mol. Mass.:
552.686
SMILES:
CC(C)Oc1ccc(CN(CCC(N)=O)C(=O)c2cnn(Cc3ccccc3)c2-c2ccc3sccc3c2)cc1
Structure:
Search PDB for entries with ligand similarity: