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SMILES: [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21

InChI Key: InChIKey=HJFXHEHQQHYWJU-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50111433   
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 1/G2/mitotic-specific cyclin-B1/G2/mitotic-specific cyclin-B2/G2/mitotic-specific cyclin-B3


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a 4.50E+4n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of Cell division cycle 2 (CDK1)-cyclin B


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair
O94806/P05129/P05771/P17252/P24723/P41743/Q02156/Q04759/Q05513/Q05655/Q15139


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a>2.50E+5n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of protein kinase C


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a 2.20E+4n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of Cyclin-dependent kinase 2-cyclin A


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a>2.50E+5n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of p56 Lck tyrosine kinase


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Fyn


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a>2.50E+5n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of Fyn kinase


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lyn


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a>2.50E+5n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of Lyn tyrosine kinase


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50111433
PNG
(1-(2-Chloro-5-nitro-phenyl)-9H-beta-carboline | CH...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)-c1nccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C17H10ClN3O2/c18-14-6-5-10(21(22)23)9-13(14)16-17-12(7-8-19-16)11-3-1-2-4-15(11)20-17/h1-9,20H
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n/an/a>1.20E+6n/an/an/an/an/an/a



Institute of Molecular and Cell Biology

Curated by ChEMBL


Assay Description
Inhibition of Cyclin-dependent kinase 5-p35nck5a


Bioorg Med Chem Lett 12: 1129-32 (2002)


BindingDB Entry DOI: 10.7270/Q2CC1006
More data for this
Ligand-Target Pair