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BDBM50025916 CHEMBL3335225

SMILES: Oc1ccc(Br)cc1\C=N\c1ccc2[nH]c(=O)[nH]c2c1

InChI Key: InChIKey=ZVAZYZFTSFSLNW-FRKPEAEDSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50025916   
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
Tyrosine-protein kinase BRK


(Homo sapiens (Human))
BDBM50025916
PNG
(CHEMBL3335225)
Show SMILES Oc1ccc(Br)cc1\C=N\c1ccc2[nH]c(=O)[nH]c2c1
Show InChI InChI=1S/C14H10BrN3O2/c15-9-1-4-13(19)8(5-9)7-16-10-2-3-11-12(6-10)18-14(20)17-11/h1-7,19H,(H2,17,18,20)/b16-7+
PDB
MMDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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Similars

Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Yonsei University

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged PTK6 (unknown origin) assessed as phosphorylated tyrosines after 20 mins by ELISA


Bioorg Med Chem Lett 24: 4659-63 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.036
BindingDB Entry DOI: 10.7270/Q2TH8P84
More data for this
Ligand-Target Pair
Tyrosine-protein kinase BRK


(Homo sapiens (Human))
BDBM50025916
PNG
(CHEMBL3335225)
Show SMILES Oc1ccc(Br)cc1\C=N\c1ccc2[nH]c(=O)[nH]c2c1
Show InChI InChI=1S/C14H10BrN3O2/c15-9-1-4-13(19)8(5-9)7-16-10-2-3-11-12(6-10)18-14(20)17-11/h1-7,19H,(H2,17,18,20)/b16-7+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

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



Yonsei University

Curated by ChEMBL


Assay Description
Inhibition of PTK6 (unknown origin) expressed in HEK293 cells assessed as decrease in tyrosine phosphorylation by chemiluminescence assay


Bioorg Med Chem Lett 24: 4659-63 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.036
BindingDB Entry DOI: 10.7270/Q2TH8P84
More data for this
Ligand-Target Pair