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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50101803   
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
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50101803
PNG
(CHEMBL3398174)
Show SMILES COc1ccccc1-c1ccc2cnc(Nc3ccc(cc3OC)[C@@H]3CCN(CCO)C[C@@H]3O)nn12 |r|
Show InChI InChI=1S/C27H31N5O4/c1-35-25-6-4-3-5-21(25)23-10-8-19-16-28-27(30-32(19)23)29-22-9-7-18(15-26(22)36-2)20-11-12-31(13-14-33)17-24(20)34/h3-10,15-16,20,24,33-34H,11-14,17H2,1-2H3,(H,29,30)/t20-,24-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Teva Branded Pharmaceutical Products R&D, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK (unknown origin) by enzymatic assay


Bioorg Med Chem Lett 25: 1047-52 (2015)


Article DOI: 10.1016/j.bmcl.2015.01.019
BindingDB Entry DOI: 10.7270/Q2GB25SJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50101803
PNG
(CHEMBL3398174)
Show SMILES COc1ccccc1-c1ccc2cnc(Nc3ccc(cc3OC)[C@@H]3CCN(CCO)C[C@@H]3O)nn12 |r|
Show InChI InChI=1S/C27H31N5O4/c1-35-25-6-4-3-5-21(25)23-10-8-19-16-28-27(30-32(19)23)29-22-9-7-18(15-26(22)36-2)20-11-12-31(13-14-33)17-24(20)34/h3-10,15-16,20,24,33-34H,11-14,17H2,1-2H3,(H,29,30)/t20-,24-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 60n/an/an/an/an/an/a



Teva Branded Pharmaceutical Products R&D, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK (unknown origin) by cellular assay


Bioorg Med Chem Lett 25: 1047-52 (2015)


Article DOI: 10.1016/j.bmcl.2015.01.019
BindingDB Entry DOI: 10.7270/Q2GB25SJ
More data for this
Ligand-Target Pair