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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50186754   
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
ATP-dependent translocase ABCB1


(Homo sapiens (Human))
BDBM50186754
PNG
(2,6-di-tert-butyl-4-[(E)-2-(3,5-dimethoxy-phenyl)-...)
Show SMILES COc1cc(OC)cc(\C=C\c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c1
Show InChI InChI=1S/C24H32O3/c1-23(2,3)20-13-17(14-21(22(20)25)24(4,5)6)10-9-16-11-18(26-7)15-19(12-16)27-8/h9-15,25H,1-8H3/b10-9+
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ di Bologna

Curated by ChEMBL


Assay Description
Antiproliferative activity against MDR human HL60R cell line


J Med Chem 49: 3012-8 (2006)


Article DOI: 10.1021/jm060253o
BindingDB Entry DOI: 10.7270/Q2R49RKZ
More data for this
Ligand-Target Pair
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM50186754
PNG
(2,6-di-tert-butyl-4-[(E)-2-(3,5-dimethoxy-phenyl)-...)
Show SMILES COc1cc(OC)cc(\C=C\c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c1
Show InChI InChI=1S/C24H32O3/c1-23(2,3)20-13-17(14-21(22(20)25)24(4,5)6)10-9-16-11-18(26-7)15-19(12-16)27-8/h9-15,25H,1-8H3/b10-9+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ di Bologna

Curated by ChEMBL


Assay Description
Antiproliferative activity against human K562 cell line expressing Bcr-Abl


J Med Chem 49: 3012-8 (2006)


Article DOI: 10.1021/jm060253o
BindingDB Entry DOI: 10.7270/Q2R49RKZ
More data for this
Ligand-Target Pair