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Compile Data Set for Download or QSAR

Found 25 hits of ki data for polymerid = 50001635   
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
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50596594
PNG
(CHEMBL5182936)
Show SMILES CCCn1c2CCNC(=O)c2cc1-c1ccncc1
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60n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM27400
PNG
(1-ethyl-2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,...)
Show SMILES CCn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C14H15N3O/c1-2-17-12-5-8-16-14(18)11(12)9-13(17)10-3-6-15-7-4-10/h3-4,6-7,9H,2,5,8H2,1H3,(H,16,18)
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108n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM27344
PNG
(2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyri...)
Show SMILES O=C1NCCc2[nH]c(cc12)-c1ccncc1
Show InChI InChI=1S/C12H11N3O/c16-12-9-7-11(8-1-4-13-5-2-8)15-10(9)3-6-14-12/h1-2,4-5,7,15H,3,6H2,(H,14,16)
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150n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM27401
PNG
(1-(2-hydroxyethyl)-2-(pyridin-4-yl)-1H,4H,5H,6H,7H...)
Show SMILES OCCn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C14H15N3O2/c18-8-7-17-12-3-6-16-14(19)11(12)9-13(17)10-1-4-15-5-2-10/h1-2,4-5,9,18H,3,6-8H2,(H,16,19)
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220n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50596601
PNG
(CHEMBL5175087)
Show SMILES O=C1NC(Cc2[nH]c(cc12)-c1ccncc1)c1ccccc1
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260n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545100
PNG
(CHEMBL1990482)
Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C13H10N4O/c14-12(18)9-2-1-3-10-11(9)17-13(16-10)8-4-6-15-7-5-8/h1-7H,(H2,14,18)(H,16,17)
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540n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50596600
PNG
(CHEMBL5202568)
Show SMILES O=C1CCCc2[nH]c(cc12)-c1ccncc1
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650n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50596595
PNG
(CHEMBL5187643)
Show SMILES CC(C)n1c2CCNC(=O)c2cc1-c1ccncc1
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920n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50596596
PNG
(CHEMBL5170263)
Show SMILES O=C1NCCc2c1cc(-c1ccncc1)n2Cc1ccccc1
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1.50E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545113
PNG
(CHEMBL4647033)
Show SMILES NC(=O)c1cc(Br)cc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C13H9BrN4O/c14-8-5-9(12(15)19)11-10(6-8)17-13(18-11)7-1-3-16-4-2-7/h1-6H,(H2,15,19)(H,17,18)
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2.19E+3n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM27394
PNG
(1-methyl-2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3...)
Show SMILES Cn1c2CCNC(=O)c2cc1-c1ccncc1
Show InChI InChI=1S/C13H13N3O/c1-16-11-4-7-15-13(17)10(11)8-12(16)9-2-5-14-6-3-9/h2-3,5-6,8H,4,7H2,1H3,(H,15,17)
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2.20E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128588
BindingDB Entry DOI: 10.7270/Q25D8WV9
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545105
PNG
(CHEMBL4635777)
Show SMILES CNC(=O)c1cccc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C14H12N4O/c1-15-14(19)10-3-2-4-11-12(10)18-13(17-11)9-5-7-16-8-6-9/h2-8H,1H3,(H,15,19)(H,17,18)
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5.20E+3n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545111
PNG
(CHEMBL4634210)
Show SMILES N#Cc1ccc2[nH]c(nc2c1)-c1ccncc1
Show InChI InChI=1S/C13H8N4/c14-8-9-1-2-11-12(7-9)17-13(16-11)10-3-5-15-6-4-10/h1-7H,(H,16,17)
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1.89E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545109
PNG
(CHEMBL4632420)
Show SMILES COC(=O)c1cccc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C14H11N3O2/c1-19-14(18)10-3-2-4-11-12(10)17-13(16-11)9-5-7-15-8-6-9/h2-8H,1H3,(H,16,17)
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1.91E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM55759
PNG
(2-(4-pyridyl)-1H-benzimidazole | 2-pyridin-4-yl-1H...)
Show SMILES c1ccc2[nH]c(nc2c1)-c1ccncc1
Show InChI InChI=1S/C12H9N3/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H,(H,14,15)
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2.24E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545101
PNG
(CHEMBL4636367)
Show SMILES COC(=O)Cn1c(nc2c(cccc12)C(N)=O)-c1ccncc1
Show InChI InChI=1S/C16H14N4O3/c1-23-13(21)9-20-12-4-2-3-11(15(17)22)14(12)19-16(20)10-5-7-18-8-6-10/h2-8H,9H2,1H3,(H2,17,22)
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2.59E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545106
PNG
(CHEMBL4649365)
Show SMILES CN(C)C(=O)c1cccc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C15H14N4O/c1-19(2)15(20)11-4-3-5-12-13(11)18-14(17-12)10-6-8-16-9-7-10/h3-9H,1-2H3,(H,17,18)
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2.78E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545110
PNG
(CHEMBL4638916)
Show SMILES CCOC(=O)c1ccc2[nH]c(nc2c1)-c1ccncc1
Show InChI InChI=1S/C15H13N3O2/c1-2-20-15(19)11-3-4-12-13(9-11)18-14(17-12)10-5-7-16-8-6-10/h3-9H,2H2,1H3,(H,17,18)
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2.78E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545108
PNG
(CHEMBL4646744)
Show SMILES [O-][N+](=O)c1cccc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C12H8N4O2/c17-16(18)10-3-1-2-9-11(10)15-12(14-9)8-4-6-13-7-5-8/h1-7H,(H,14,15)
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2.89E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545104
PNG
(CHEMBL4645636)
Show SMILES COc1cc(ccn1)-c1nc2c(cccc2[nH]1)C(N)=O
Show InChI InChI=1S/C14H12N4O2/c1-20-11-7-8(5-6-16-11)14-17-10-4-2-3-9(13(15)19)12(10)18-14/h2-7H,1H3,(H2,15,19)(H,17,18)
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3.02E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545102
PNG
(CHEMBL185288)
Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1cccnc1
Show InChI InChI=1S/C13H10N4O/c14-12(18)9-4-1-5-10-11(9)17-13(16-10)8-3-2-6-15-7-8/h1-7H,(H2,14,18)(H,16,17)
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3.25E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545107
PNG
(CHEMBL4637286)
Show SMILES NC(=O)c1ccc2[nH]c(nc2c1)-c1ccncc1
Show InChI InChI=1S/C13H10N4O/c14-12(18)9-1-2-10-11(7-9)17-13(16-10)8-3-5-15-6-4-8/h1-7H,(H2,14,18)(H,16,17)
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4.88E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545112
PNG
(CHEMBL160012)
Show SMILES [O-][N+](=O)c1ccc2[nH]c(nc2c1)-c1ccncc1
Show InChI InChI=1S/C12H8N4O2/c17-16(18)9-1-2-10-11(7-9)15-12(14-10)8-3-5-13-6-4-8/h1-7H,(H,14,15)
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5.37E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545103
PNG
(CHEMBL4640475)
Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1cncnc1
Show InChI InChI=1S/C12H9N5O/c13-11(18)8-2-1-3-9-10(8)17-12(16-9)7-4-14-6-15-5-7/h1-6H,(H2,13,18)(H,16,17)
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6.77E+4n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Displacement of tracer from PKN1 (unknown origin) by TR-FRET assay


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase N1


(Homo sapiens (Human))
BDBM50545100
PNG
(CHEMBL1990482)
Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1ccncc1
Show InChI InChI=1S/C13H10N4O/c14-12(18)9-2-1-3-10-11(9)17-13(16-10)8-4-6-15-7-5-8/h1-7H,(H2,14,18)(H,16,17)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
<1.00E+5n/an/an/an/an/an/an/an/a



University of Sussex

Curated by ChEMBL


Assay Description
Inhibition of His/GST-tagged PKN1 (unknown origin) using biotinylated peptide as substrate measured after 1 hr in presence of [gamma-33P]-ATP by fluo...


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127040
BindingDB Entry DOI: 10.7270/Q2SJ1Q61
More data for this
Ligand-Target Pair