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BDBM50360499 CHEMBL1935207

SMILES: COc1ccc(cc1OC)C(=O)\C=C\c1ccccc1Cl

InChI Key: InChIKey=MWDJSQKNDLOBLB-VQHVLOKHSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50360499   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ATP-binding cassette sub-family G member 2


(Homo sapiens (Human))
BDBM50360499
PNG
(CHEMBL1935207)
Show SMILES COc1ccc(cc1OC)C(=O)\C=C\c1ccccc1Cl
Show InChI InChI=1S/C17H15ClO3/c1-20-16-10-8-13(11-17(16)21-2)15(19)9-7-12-5-3-4-6-14(12)18/h3-11H,1-2H3/b9-7+
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.80E+3n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human BCRP expressed in MDCK2 cells assessed as Hoechst 33342 accumulation preincubated for 30 mins by fluorimetry


Bioorg Med Chem 20: 346-55 (2011)


Article DOI: 10.1016/j.bmc.2011.10.074
BindingDB Entry DOI: 10.7270/Q24X587H
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family G member 2


(Homo sapiens (Human))
BDBM50360499
PNG
(CHEMBL1935207)
Show SMILES COc1ccc(cc1OC)C(=O)\C=C\c1ccccc1Cl
Show InChI InChI=1S/C17H15ClO3/c1-20-16-10-8-13(11-17(16)21-2)15(19)9-7-12-5-3-4-6-14(12)18/h3-11H,1-2H3/b9-7+
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of BCRP in human MCF7/MX cells assessed as Hoechst 33342 accumulation preincubated for 30 mins by Fluorometry


Bioorg Med Chem 20: 346-55 (2011)


Article DOI: 10.1016/j.bmc.2011.10.074
BindingDB Entry DOI: 10.7270/Q24X587H
More data for this
Ligand-Target Pair