BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetMultidrug efflux pump
LigandBDBM84143
Substrate/Competitorn/a
Meas. Tech.Dose Response HTS singleplex for inhibitors of yeast efflux pump, specifically Mdr1 with Hit compounds from Cherry Pick1
EC50 9580±n/a nM
Citation PubChem, PC Dose Response HTS singleplex for inhibitors of yeast efflux pump, specifically Mdr1 with Hit compounds from Cherry Pick1 PubChem Bioassay(2011)[AID]
More Info.:Get all data from this article,  Assay Method
 
Multidrug efflux pump
Name:Multidrug efflux pump
Synonyms:Candida albicans strain ATCC 10261 multidrug efflux pump (MDR1) gene, MDR1-A allele, complete cds
Type:Enzyme Catalytic Domain
Mol. Mass.:62915.82
Organism:Candida albicans
Description:Q09GR2
Residue:564
Sequence:
MHYRFLRDSFVGRVTYHLSKHKYFAHPEEAKDYIVPEKYLADYKPTLADDTSINFEKEEI
DNQGEPNSSQSSSSNNTIVDNNNNNDNDVDGDKIVVTWDGDDDPENPQNWPTLQKAFFIF
QISFLTTSVYMGSAVYTPGIEELMHDFGIGRVVATLPLTLFVIGYGVGPLVFSPMSENAI
FGRTSIYIITLFLFVILQIPTALVNNIAGLCILRFLGGFFASPCLATGGASVADVVKFWN
LPVGLAAWSLGAVCGPSFGPFFGSILTVKASWRWTFWFMCIISGFSFVMLCFTLPETFGK
TLLYRKAKRLRAITGNDRITSEGEIENSKMTSHELIIDTLWRPLEITVMEPVVLLINIYI
AMVYSILYLFFEVFPIYFVGVKHFTLVELGTTYMSIVIGIVIAAFIYIPVIRQKFTKPIL
RQEQVFPEVFIPIAIVGGILLTSGLFIFGWSANRTTHWVGPLFGAATTASGAFLIFQTLF
NFMGASFKPHYIASVFASNDLFRSVIASVFPLFGAPLFDNLATPEYPVAWGSSVLGFITL
VMIAIPVLFYLNGPKLRARSKYAN
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM84143
n/a
NameBDBM84143
Synonyms:3-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-5-phenyl-3,4-dihydropyrazole | 5-(2,3-dimethoxyphenyl)-3-phenyl-1-tosyl-2-pyrazoline | MLS000680475 | SMR000324612 | cid_5052359
TypeSmall organic molecule
Emp. Form.C24H24N2O4S
Mol. Mass.436.523
SMILESCOc1cccc(C2CC(=NN2S(=O)(=O)c2ccc(C)cc2)c2ccccc2)c1OC |c:9|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: