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BDBM50097877 CHEMBL3589657

SMILES: Cc1ccc2[nH]c3c(c(nc4ccccc34)C(O)=O)c2c1

InChI Key: InChIKey=ZOYFHKSBGNUZAO-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50097877   
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
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50097877
PNG
(CHEMBL3589657)
Show SMILES Cc1ccc2[nH]c3c(c(nc4ccccc34)C(O)=O)c2c1
Show InChI InChI=1S/C17H12N2O2/c1-9-6-7-13-11(8-9)14-15(18-13)10-4-2-3-5-12(10)19-16(14)17(20)21/h2-8,18H,1H3,(H,20,21)
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Technische Universit£t Braunschweig

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK2 using [gamma-33P]ATP as substrate after 30 mins by scintillation counting analysis


J Med Chem 58: 3131-43 (2015)


Article DOI: 10.1021/jm501994d
BindingDB Entry DOI: 10.7270/Q2736SPK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM50097877
PNG
(CHEMBL3589657)
Show SMILES Cc1ccc2[nH]c3c(c(nc4ccccc34)C(O)=O)c2c1
Show InChI InChI=1S/C17H12N2O2/c1-9-6-7-13-11(8-9)14-15(18-13)10-4-2-3-5-12(10)19-16(14)17(20)21/h2-8,18H,1H3,(H,20,21)
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Technische Universit£t Braunschweig

Curated by ChEMBL


Assay Description
Inhibition of ERK2 (unknown origin)


J Med Chem 58: 3131-43 (2015)


Article DOI: 10.1021/jm501994d
BindingDB Entry DOI: 10.7270/Q2736SPK
More data for this
Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 1A


(Homo sapiens (Human))
BDBM50097877
PNG
(CHEMBL3589657)
Show SMILES Cc1ccc2[nH]c3c(c(nc4ccccc34)C(O)=O)c2c1
Show InChI InChI=1S/C17H12N2O2/c1-9-6-7-13-11(8-9)14-15(18-13)10-4-2-3-5-12(10)19-16(14)17(20)21/h2-8,18H,1H3,(H,20,21)
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Technische Universit£t Braunschweig

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DYRK1A expressed in Escherichia coli using RS peptide as substrate


J Med Chem 58: 3131-43 (2015)


Article DOI: 10.1021/jm501994d
BindingDB Entry DOI: 10.7270/Q2736SPK
More data for this
Ligand-Target Pair
Cyclin-dependent-like kinase 5


(Homo sapiens (Human))
BDBM50097877
PNG
(CHEMBL3589657)
Show SMILES Cc1ccc2[nH]c3c(c(nc4ccccc34)C(O)=O)c2c1
Show InChI InChI=1S/C17H12N2O2/c1-9-6-7-13-11(8-9)14-15(18-13)10-4-2-3-5-12(10)19-16(14)17(20)21/h2-8,18H,1H3,(H,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Technische Universit£t Braunschweig

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CDK5 using [gamma-33P]ATP as substrate after 30 mins by scintillation counting analysis


J Med Chem 58: 3131-43 (2015)


Article DOI: 10.1021/jm501994d
BindingDB Entry DOI: 10.7270/Q2736SPK
More data for this
Ligand-Target Pair