BindingDB logo
myBDB logout

BDBM50506718 CHEMBL1098827

SMILES: O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O

InChI Key: InChIKey=PMNWPSRSXHKOQI-GHRIWEEISA-N

Data: 2 IC50  6 Kd

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 8 hits for monomerid = 50506718   
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
NT-3 growth factor receptor


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.30E+4n/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Binding affinity to human partial length TRKC (Q531 to G825 residues) expressed in HEK293 cells measured after 1 hr by Kinomescan method


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 9


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.00E+3n/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Binding affinity to human full-length JNK2 (M1 to Q382 residues) expressed in HEK293 cells measured after 1 hr by Kinomescan method


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 275n/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Binding affinity to human partial length JNK3 (V28 to Q422 residues) expressed in HEK293 cells measured after 1 hr by Kinomescan method


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10/8/9


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.20E+3n/an/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Inhibition of JNK in human MONO-MAC-6 cells assessed as reduction in LPS-induced IL6 production preincubated for 30 mins followed by LPS-stimulation ...


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.10E+3n/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Binding affinity to human partial length TRKA (G475 to G790 residues) expressed in HEK293 cells measured after 1 hr by Kinomescan method


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 150n/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Binding affinity to human full-length JNK1 (M1 to Q384 residues) expressed in HEK293 cells measured after 1 hr by Kinomescan method


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 3.80E+3n/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Binding affinity to human partial length TRKB (Q547 to G838 residues) expressed in HEK293 cells measured after 1 hr by Kinomescan method


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10/8/9


(Homo sapiens (Human))
BDBM50506718
PNG
(CHEMBL1098827)
Show SMILES O\N=C1/c2ccccc2-n2c1nc1ccccc1c2=O
Show InChI InChI=1S/C15H9N3O2/c19-15-9-5-1-3-7-11(9)16-14-13(17-20)10-6-2-4-8-12(10)18(14)15/h1-8,20H/b17-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



Montana State University

Curated by ChEMBL


Assay Description
Inhibition of JNK in human THP1-Blue cells assessed as reduction in LPS-induced NFkappaB/AP1 activation preincubated for 30 mins followed by LPS-stim...


Eur J Med Chem 161: 179-191 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.023
More data for this
Ligand-Target Pair