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BDBM50343673 4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-ylamino)piperidine-1-sulfonamide::CHEMBL1773329

SMILES: NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1

InChI Key: InChIKey=OMXIAXJGEYOQEC-UHFFFAOYSA-N

Data: 7 IC50

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 7 hits for monomerid = 50343673   
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
Inhibitor of nuclear factor kappa-B kinase subunit alpha


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 2.04E+4n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of IKK1


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 920n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of IKK2 using 5-FAM-GRHDSGLDSMK-NH2 as substrate by TR-FRET assay


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 9


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of JNK2


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 8


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 480n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of JNK1


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of p38alpha


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 210n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of p38beta


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50343673
PNG
(4-(4-(4-(morpholinosulfonyl)phenyl)pyrimidin-2-yla...)
Show SMILES NS(=O)(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C19H26N6O5S2/c20-32(28,29)25-9-6-16(7-10-25)22-19-21-8-5-18(23-19)15-1-3-17(4-2-15)31(26,27)24-11-13-30-14-12-24/h1-5,8,16H,6-7,9-14H2,(H2,20,28,29)(H,21,22,23)
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n/an/a 880n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of JNK3


Bioorg Med Chem Lett 21: 3002-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.044
BindingDB Entry DOI: 10.7270/Q22V2GDS
More data for this
Ligand-Target Pair