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5 similar compounds to monomer 50345242

Compile data set for download or QSAR
Wt: 352.3
BDBM50345238		Wt: 352.3
BDBM50345243		Wt: 338.3
BDBM50345244		Wt: 366.4
BDBM50345245		Wt: 310.3
BDBM50345246

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50345238,50345243,50345244,50345245,50345246   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))		BDBM50345238
PNG
(5-(6-(piperidin-4-ylmethylamino)pyrazin-2-yl)benzo...)
Show SMILES OC(=O)c1cc2cc(ccc2o1)-c1cncc(NCC2CCNCC2)n1
Show InChI InChI=1S/C19H20N4O3/c24-19(25)17-8-14-7-13(1-2-16(14)26-17)15-10-21-11-18(23-15)22-9-12-3-5-20-6-4-12/h1-2,7-8,10-12,20H,3-6,9H2,(H,22,23)(H,24,25)
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n/an/a 380n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim1 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 45 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))		BDBM50345243
PNG
(CHEMBL1782514 | cis-5-(6-(4-aminocyclohexylamino)p...)
Show SMILES N[C@H]1CC[C@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O
Show InChI InChI=1S/C19H20N4O3/c20-13-2-4-14(5-3-13)22-18-10-21-9-15(23-18)11-1-6-16-12(7-11)8-17(26-16)19(24)25/h1,6-10,13-14H,2-5,20H2,(H,22,23)(H,24,25)/t13-,14+
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n/an/a 200n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim1 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 45 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))		BDBM50345244
PNG
(5-(6-(piperidin-4-ylamino)pyrazin-2-yl)benzofuran-...)
Show SMILES OC(=O)c1cc2cc(ccc2o1)-c1cncc(NC2CCNCC2)n1
Show InChI InChI=1S/C18H18N4O3/c23-18(24)16-8-12-7-11(1-2-15(12)25-16)14-9-20-10-17(22-14)21-13-3-5-19-6-4-13/h1-2,7-10,13,19H,3-6H2,(H,21,22)(H,23,24)
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n/an/a 210n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim1 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 45 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))		BDBM50345245
PNG
(CHEMBL1782516 | trans-5-(6-(4-(aminomethyl)cyclohe...)
Show SMILES NC[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O
Show InChI InChI=1S/C20H22N4O3/c21-9-12-1-4-15(5-2-12)23-19-11-22-10-16(24-19)13-3-6-17-14(7-13)8-18(27-17)20(25)26/h3,6-8,10-12,15H,1-2,4-5,9,21H2,(H,23,24)(H,25,26)/t12-,15-
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n/an/a 53n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim1 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 45 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))		BDBM50345246
PNG
(5-(6-(azetidin-3-ylamino)pyrazin-2-yl)benzofuran-2...)
Show SMILES OC(=O)c1cc2cc(ccc2o1)-c1cncc(NC2CNC2)n1
Show InChI InChI=1S/C16H14N4O3/c21-16(22)14-4-10-3-9(1-2-13(10)23-14)12-7-18-8-15(20-12)19-11-5-17-6-11/h1-4,7-8,11,17H,5-6H2,(H,19,20)(H,21,22)
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Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim2 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 90 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))		BDBM50345238
PNG
(5-(6-(piperidin-4-ylmethylamino)pyrazin-2-yl)benzo...)
Show SMILES OC(=O)c1cc2cc(ccc2o1)-c1cncc(NCC2CCNCC2)n1
Show InChI InChI=1S/C19H20N4O3/c24-19(25)17-8-14-7-13(1-2-16(14)26-17)15-10-21-11-18(23-15)22-9-12-3-5-20-6-4-12/h1-2,7-8,10-12,20H,3-6,9H2,(H,22,23)(H,24,25)
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n/an/a 160n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim2 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 90 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))		BDBM50345243
PNG
(CHEMBL1782514 | cis-5-(6-(4-aminocyclohexylamino)p...)
Show SMILES N[C@H]1CC[C@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O
Show InChI InChI=1S/C19H20N4O3/c20-13-2-4-14(5-3-13)22-18-10-21-9-15(23-18)11-1-6-16-12(7-11)8-17(26-16)19(24)25/h1,6-10,13-14H,2-5,20H2,(H,22,23)(H,24,25)/t13-,14+
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n/an/a 110n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim2 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 90 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))		BDBM50345244
PNG
(5-(6-(piperidin-4-ylamino)pyrazin-2-yl)benzofuran-...)
Show SMILES OC(=O)c1cc2cc(ccc2o1)-c1cncc(NC2CCNCC2)n1
Show InChI InChI=1S/C18H18N4O3/c23-18(24)16-8-12-7-11(1-2-15(12)25-16)14-9-20-10-17(22-14)21-13-3-5-19-6-4-13/h1-2,7-10,13,19H,3-6H2,(H,21,22)(H,23,24)
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n/an/a 150n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim2 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 90 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))		BDBM50345245
PNG
(CHEMBL1782516 | trans-5-(6-(4-(aminomethyl)cyclohe...)
Show SMILES NC[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O
Show InChI InChI=1S/C20H22N4O3/c21-9-12-1-4-15(5-2-12)23-19-11-22-10-16(24-19)13-3-6-17-14(7-13)8-18(27-17)20(25)26/h3,6-8,10-12,15H,1-2,4-5,9,21H2,(H,23,24)(H,25,26)/t12-,15-
PDB
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n/an/a 21n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim2 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 90 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))		BDBM50345246
PNG
(5-(6-(azetidin-3-ylamino)pyrazin-2-yl)benzofuran-2...)
Show SMILES OC(=O)c1cc2cc(ccc2o1)-c1cncc(NC2CNC2)n1
Show InChI InChI=1S/C16H14N4O3/c21-16(22)14-4-10-3-9(1-2-13(10)23-14)12-7-18-8-15(20-12)19-11-5-17-6-11/h1-4,7-8,11,17H,5-6H2,(H,19,20)(H,21,22)
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n/an/a 450n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Inhibition of human Pim1 using 5-FAM-RSRHSSYPAGT-CONH2 as substrate after 45 mins by off-chip mobility shift method

Bioorg Med Chem Lett 21: 3050-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.03.030
BindingDB Entry DOI: 10.7270/Q2ZP46GG
More data for this
Ligand-Target Pair