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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Multidrug resistance-associated protein 1' and Ligand = 'BDBM44635'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Multidrug resistance-associated protein 1


(Homo sapiens (Human))
BDBM44635
PNG
((2Z)-2-[3-[2-(3-bromophenoxy)ethyl]-4-keto-thiazol...)
Show SMILES CCOC(=O)\C=C1/SCC(=O)N1CCOc1cccc(Br)c1
Show InChI InChI=1S/C15H16BrNO4S/c1-2-20-15(19)9-14-17(13(18)10-22-14)6-7-21-12-5-3-4-11(16)8-12/h3-5,8-9H,2,6-7,10H2,1H3/b14-9-
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 6.50E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q25719FH
More data for this
Ligand-Target Pair