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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for UniProtKB: P43071   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Multidrug resistance protein CDR1


(Candida albicans)
BDBM50067040
PNG
(((E,E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-1,6-hept...)
Show SMILES COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3
UniProtKB/SwissProt

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CHEMBL
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PC sid
PDB
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Article
PubMed
n/an/a 1.42E+4n/an/an/an/an/an/a



Jawaharlal Nehru University

Curated by ChEMBL


Assay Description
Displacement of [125I]IAAP from GFP-tagged Candida albicans CDR1 expressed in Saccharomyces cerevisiae


Antimicrob Agents Chemother 53: 3256-65 (2009)


Article DOI: 10.1128/AAC.01497-08
BindingDB Entry DOI: 10.7270/Q2BP032R
More data for this
Ligand-Target Pair
Multidrug resistance protein CDR1


(Candida albicans)
BDBM50059989
PNG
((1E,4Z,6E)-5-Hydroxy-1,7-bis-(4-hydroxy-phenyl)-he...)
Show SMILES Oc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)cc1
Show InChI InChI=1S/C19H16O4/c20-16-7-1-14(2-8-16)5-11-18(22)13-19(23)12-6-15-3-9-17(21)10-4-15/h1-12,20-21H,13H2
UniProtKB/SwissProt

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CHEBI
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



Jawaharlal Nehru University

Curated by ChEMBL


Assay Description
Inhibition of GFP-tagged Candida albicans CDR1 expressed in Saccharomyces cerevisiae assessed as inhibition of R6G efflux


Antimicrob Agents Chemother 53: 3256-65 (2009)


Article DOI: 10.1128/AAC.01497-08
BindingDB Entry DOI: 10.7270/Q2BP032R
More data for this
Ligand-Target Pair
Multidrug resistance protein CDR1


(Candida albicans)
BDBM50067040
PNG
(((E,E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-1,6-hept...)
Show SMILES COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
PDB
UniChem

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Article
PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



Jawaharlal Nehru University

Curated by ChEMBL


Assay Description
Inhibition of GFP-tagged Candida albicans CDR1 expressed in Saccharomyces cerevisiae assessed as inhibition of R6G efflux


Antimicrob Agents Chemother 53: 3256-65 (2009)


Article DOI: 10.1128/AAC.01497-08
BindingDB Entry DOI: 10.7270/Q2BP032R
More data for this
Ligand-Target Pair
Multidrug resistance protein CDR1


(Candida albicans)
BDBM50163744
PNG
((1E,4Z,6E)-5-Hydroxy-1-(4-hydroxy-3-methoxy-phenyl...)
Show SMILES COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)ccc1O
Show InChI InChI=1S/C20H18O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-12,21,24H,13H2,1H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
PubMed
n/an/a 4.50E+4n/an/an/an/an/an/a



Jawaharlal Nehru University

Curated by ChEMBL


Assay Description
Inhibition of GFP-tagged Candida albicans CDR1 expressed in Saccharomyces cerevisiae assessed as inhibition of R6G efflux


Antimicrob Agents Chemother 53: 3256-65 (2009)


Article DOI: 10.1128/AAC.01497-08
BindingDB Entry DOI: 10.7270/Q2BP032R
More data for this
Ligand-Target Pair