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BDBM50448823 CHEMBL3128235

SMILES: O=C(Nc1ccccc1)Nc1cccc(CNc2ncnc3n(CCc4ccccc4)ncc23)c1

InChI Key: InChIKey=UXBCWMIUYACOCC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50448823   
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
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM50448823
PNG
(CHEMBL3128235)
Show SMILES O=C(Nc1ccccc1)Nc1cccc(CNc2ncnc3n(CCc4ccccc4)ncc23)c1
Show InChI InChI=1S/C27H25N7O/c35-27(32-22-11-5-2-6-12-22)33-23-13-7-10-21(16-23)17-28-25-24-18-31-34(26(24)30-19-29-25)15-14-20-8-3-1-4-9-20/h1-13,16,18-19H,14-15,17H2,(H,28,29,30)(H2,32,33,35)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.04E+3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibition of recombinant human RET incubated for 5 mins with substrate prior to protein addition by fluorescence assay


J Med Chem 57: 1225-35 (2014)


Article DOI: 10.1021/jm401358b
BindingDB Entry DOI: 10.7270/Q2X34ZZP
More data for this
Ligand-Target Pair