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BDBM50181680 6-oxo-1,6-dihydro-[3,4']bipyridinyl-5-carboxylic acid [4-(4-methyl-piperazin-1-ylmethyl)-phenyl]-amide::CHEMBL197652

SMILES: CN1CCN(Cc2ccc(NC(=O)c3cc(c[nH]c3=O)-c3ccncc3)cc2)CC1

InChI Key: InChIKey=MGEAZGCEEMEQLI-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50181680   
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
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50181680
PNG
(6-oxo-1,6-dihydro-[3,4']bipyridinyl-5-carboxylic a...)
Show SMILES CN1CCN(Cc2ccc(NC(=O)c3cc(c[nH]c3=O)-c3ccncc3)cc2)CC1
Show InChI InChI=1S/C23H25N5O2/c1-27-10-12-28(13-11-27)16-17-2-4-20(5-3-17)26-23(30)21-14-19(15-25-22(21)29)18-6-8-24-9-7-18/h2-9,14-15H,10-13,16H2,1H3,(H,25,29)(H,26,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.95E+4n/an/an/an/an/an/a



ChemBridge Research Laboratories and ChemBridge Corporation

Curated by ChEMBL


Assay Description
Inhibitory activity against ALK


J Med Chem 49: 1006-15 (2006)


Article DOI: 10.1021/jm050824x
BindingDB Entry DOI: 10.7270/Q2H994T6
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50181680
PNG
(6-oxo-1,6-dihydro-[3,4']bipyridinyl-5-carboxylic a...)
Show SMILES CN1CCN(Cc2ccc(NC(=O)c3cc(c[nH]c3=O)-c3ccncc3)cc2)CC1
Show InChI InChI=1S/C23H25N5O2/c1-27-10-12-28(13-11-27)16-17-2-4-20(5-3-17)26-23(30)21-14-19(15-25-22(21)29)18-6-8-24-9-7-18/h2-9,14-15H,10-13,16H2,1H3,(H,25,29)(H,26,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



ChemBridge Research Laboratories and ChemBridge Corporation

Curated by ChEMBL


Assay Description
Inhibitory activity against IRK


J Med Chem 49: 1006-15 (2006)


Article DOI: 10.1021/jm050824x
BindingDB Entry DOI: 10.7270/Q2H994T6
More data for this
Ligand-Target Pair