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5 similar compounds to monomer 50278193

Compile data set for download or QSAR
Wt: 300.3
BDBM47548
Wt: 346.3
BDBM50159293
Wt: 344.3
BDBM50159295
Wt: 299.3
BDBM50278194
Wt: 344.3
BDBM50403019
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 47548,50159293,50159295,50278194,50403019   
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
electroneutral potassium-chloride cotransporter KCC2


(Homo sapiens (Human))
BDBM47548
PNG
((E)-1-(2,3-dihydroxy-4,6-dimethoxy-phenyl)-3-pheny...)
Show SMILES COc1cc(OC)c(C(=O)\C=C\c2ccccc2)c(O)c1O
Show InChI InChI=1S/C17H16O5/c1-21-13-10-14(22-2)16(19)17(20)15(13)12(18)9-8-11-6-4-3-5-7-11/h3-10,19-20H,1-2H3/b9-8+
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PCBioAssay
n/an/an/an/a 4.86E+5n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2M32T6M
More data for this
Ligand-Target Pair
Tubulin beta-1 chain


(Homo sapiens (Human))
BDBM50159293
PNG
((E)-3-(3,4,5-Trihydroxy-phenyl)-1-(2,3,4-trimethox...)
Show SMILES COc1ccc(C(=O)\C=C\c2cc(O)c(O)c(O)c2)c(OC)c1OC
Show InChI InChI=1S/C18H18O7/c1-23-15-7-5-11(17(24-2)18(15)25-3)12(19)6-4-10-8-13(20)16(22)14(21)9-10/h4-9,20-22H,1-3H3/b6-4+
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Salford

Curated by ChEMBL


Assay Description
Concentration required for 50% inhibition of tubulin polymerization


J Med Chem 48: 457-65 (2005)


Article DOI: 10.1021/jm049444m
BindingDB Entry DOI: 10.7270/Q2416WKV
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50403019
PNG
(CHEMBL2208193)
Show SMILES COc1ccc(\C=C\C(=O)c2c(O)cc(OC)c(OC)c2OC)cc1
Show InChI InChI=1S/C19H20O6/c1-22-13-8-5-12(6-9-13)7-10-14(20)17-15(21)11-16(23-2)18(24-3)19(17)25-4/h5-11,21H,1-4H3/b10-7+
PDB
MMDB

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Article
PubMed
n/an/an/an/a 3.10E+3n/an/an/an/a



Hebei Medical University

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma-LBD expressed in human L02 cells co-expressing pGL3-SV40-GAL4 after 24 hrs by luciferase reporter gene based transactiv...


J Nat Prod 75: 2076-81 (2012)


Article DOI: 10.1021/np300386d
BindingDB Entry DOI: 10.7270/Q2PV6MJB
More data for this
Ligand-Target Pair
Protein kinase Pfmrk


(Plasmodium falciparum)
BDBM50278194
PNG
(3-(pyridin-4-yl)-1-(2,3,4-trimethoxyphenyl)prop-2-...)
Show SMILES COc1ccc(C(=O)\C=C\c2ccncc2)c(OC)c1OC
Show InChI InChI=1S/C17H17NO4/c1-20-15-7-5-13(16(21-2)17(15)22-3)14(19)6-4-12-8-10-18-11-9-12/h4-11H,1-3H3/b6-4+
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 9.00E+3n/an/an/an/an/an/a



Institute of Research

Curated by ChEMBL


Assay Description
Inhibition of His6x-tagged Plasmodium falciparum Pfmrk expressed in Escherichia coli by microtiter plate scintillation counting


Bioorg Med Chem Lett 19: 1982-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.042
BindingDB Entry DOI: 10.7270/Q2P26Z1T
More data for this
Ligand-Target Pair
Tubulin beta-1 chain


(Homo sapiens (Human))
BDBM50159295
PNG
((E)-3-(3''-Hydroxy-4''-methoxyphenyl)-1-(20,30,40-...)
Show SMILES COc1ccc(\C=C\C(=O)c2ccc(OC)c(OC)c2OC)cc1O
Show InChI InChI=1S/C19H20O6/c1-22-16-9-6-12(11-15(16)21)5-8-14(20)13-7-10-17(23-2)19(25-4)18(13)24-3/h5-11,21H,1-4H3/b8-5+
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Article
PubMed
n/an/a 450n/an/an/an/an/an/a



University of Salford

Curated by ChEMBL


Assay Description
Concentration required for 50% inhibition of tubulin polymerization


J Med Chem 48: 457-65 (2005)


Article DOI: 10.1021/jm049444m
BindingDB Entry DOI: 10.7270/Q2416WKV
More data for this
Ligand-Target Pair