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Compile Data Set for Download or QSAR

Found 74 hits Enz. Inhib. hit(s) with Target = 'Sphingosine kinase 2' AND taxid = 10090   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241906
PNG
(US9421177, VPC96047)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O
UniProtKB/SwissProt

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US Patent
500n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241937
PNG
(US9421177, VPC96091)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O
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US Patent
1.50E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343829
PNG
((S)-1-(4-Dodecylbenzoyl)pyrrolidine-2-carboximidam...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1C(N)=N
Show InChI InChI=1S/C24H39N3O/c1-2-3-4-5-6-7-8-9-10-11-13-20-15-17-21(18-16-20)24(28)27-19-12-14-22(27)23(25)26/h15-18,22H,2-14,19H2,1H3,(H3,25,26)/t22-/m0/s1
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1.50E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241936
PNG
(US9421177, VPC96077)
Show SMILES CCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O
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US Patent
2.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241932
PNG
(US9421177, VPC95291)
Show SMILES CCCCCCCCCCCCCCCC(=O)NC1(CC1)C(\N)=N\O
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US Patent
2.60E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343831
PNG
((S)-1-(4-(7-(Cyclohexylmethoxy)heptyl)benzoyl)pyrr...)
Show SMILES NC(=N)[C@@H]1CCCN1C(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1
Show InChI InChI=1S/C26H41N3O2/c27-25(28)24-13-9-18-29(24)26(30)23-16-14-21(15-17-23)10-5-2-1-3-8-19-31-20-22-11-6-4-7-12-22/h14-17,22,24H,1-13,18-20H2,(H3,27,28)/t24-/m0/s1
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3.00E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241905
PNG
(US9421177, VPC95287)
Show SMILES CCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O
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US Patent
4.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241935
PNG
(US9421177, VPC95297)
Show SMILES CCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O
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US Patent
4.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241913
PNG
(US9421177, VPC143033)
Show SMILES CCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1
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US Patent
4.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343835
PNG
((S)-1-(4-(4-(3-(2-Cyclohexylethyl)phenyl)oxazol-2-...)
Show SMILES NC(=N)[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1nc(co1)-c1cccc(CCC2CCCCC2)c1
Show InChI InChI=1S/C29H34N4O2/c30-27(31)26-10-5-17-33(26)29(34)23-15-13-22(14-16-23)28-32-25(19-35-28)24-9-4-8-21(18-24)12-11-20-6-2-1-3-7-20/h4,8-9,13-16,18-20,26H,1-3,5-7,10-12,17H2,(H3,30,31)/t26-/m0/s1
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4.20E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241928
PNG
(US9421177, VPC143090)
Show SMILES N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC23CC4CC(CC(C4)C2)C3)cc1
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US Patent
4.60E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343820
PNG
(CHEMBL1774562 | N-(4-(7-((Adamantan-1-ylmethoxy)he...)
Show SMILES NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC23CC4CC(CC(C4)C2)C3)cc1
Show InChI InChI=1S/C29H43N3O2/c30-26(31)29(11-12-29)27(33)32-25-9-7-21(8-10-25)6-4-2-1-3-5-13-34-20-28-17-22-14-23(18-28)16-24(15-22)19-28/h7-10,22-24H,1-6,11-20H2,(H3,30,31)(H,32,33)
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4.60E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241914
PNG
(US9421177, VPC143081)
Show SMILES CCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1
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US Patent
5.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241938
PNG
(US9421177, VPC96115)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@@H]1\C(N)=N\O
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US Patent
5.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343830
PNG
((R)-1-(4-Dodecylbenzoyl)pyrrolidine-2-carboximidam...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@@H]1C(N)=N
Show InChI InChI=1S/C24H39N3O/c1-2-3-4-5-6-7-8-9-10-11-13-20-15-17-21(18-16-20)24(28)27-19-12-14-22(27)23(25)26/h15-18,22H,2-14,19H2,1H3,(H3,25,26)/t22-/m1/s1
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5.00E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343828
PNG
(CHEMBL1774570 | N-(1-Carbamimidoylcyclobutyl)-4-do...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CCC1)C(N)=N
Show InChI InChI=1S/C24H39N3O/c1-2-3-4-5-6-7-8-9-10-11-13-20-14-16-21(17-15-20)22(28)27-24(23(25)26)18-12-19-24/h14-17H,2-13,18-19H2,1H3,(H3,25,26)(H,27,28)
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5.00E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343832
PNG
((S)-1-(4-(9-cyclohexylnonyl)benzoyl)pyrrolidine-2-...)
Show SMILES NC(=N)[C@@H]1CCCN1C(=O)c1ccc(CCCCCCCCCC2CCCCC2)cc1
Show InChI InChI=1S/C27H43N3O/c28-26(29)25-16-11-21-30(25)27(31)24-19-17-23(18-20-24)15-8-5-3-1-2-4-7-12-22-13-9-6-10-14-22/h17-20,22,25H,1-16,21H2,(H3,28,29)/t25-/m0/s1
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5.30E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343836
PNG
((S)-1-(4-(4-(3-(2-Cyclohexylethyl)phenyl)thiazol-2...)
Show SMILES NC(=N)[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1nc(cs1)-c1cccc(CCC2CCCCC2)c1
Show InChI InChI=1S/C29H34N4OS/c30-27(31)26-10-5-17-33(26)29(34)23-15-13-22(14-16-23)28-32-25(19-35-28)24-9-4-8-21(18-24)12-11-20-6-2-1-3-7-20/h4,8-9,13-16,18-20,26H,1-3,5-7,10-12,17H2,(H3,30,31)/t26-/m0/s1
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PubMed
6.00E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241915
PNG
(US9421177, VPC143064)
Show SMILES CCCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1
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US Patent
6.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343818
PNG
(1-Carbamimidoyl-N-(4-(7-(cyclohexylmethoxy)heptyl)...)
Show SMILES NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC2CCCCC2)cc1
Show InChI InChI=1S/C25H39N3O2/c26-23(27)25(16-17-25)24(29)28-22-14-12-20(13-15-22)9-5-2-1-3-8-18-30-19-21-10-6-4-7-11-21/h12-15,21H,1-11,16-19H2,(H3,26,27)(H,28,29)
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7.00E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241922
PNG
(US9421177, VPC143105)
Show SMILES N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC2CCCCC2)cc1
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US Patent
7.00E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241929
PNG
(US9421177, VPC143057)
Show SMILES CCCCCCCCCCCCCCNC(=O)C1(CC1)C(\N)=N\O
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US Patent
7.50E+3n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343811
PNG
(1-Carbamimidoyl-N-tetradecylcyclopropanecarboxamid...)
Show SMILES CCCCCCCCCCCCCCNC(=O)C1(CC1)C(N)=N
Show InChI InChI=1S/C19H37N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-22-18(23)19(14-15-19)17(20)21/h2-16H2,1H3,(H3,20,21)(H,22,23)
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7.50E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50359977
PNG
(CHEMBL1927590)
Show SMILES CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC
Show InChI InChI=1S/C25H44N/c1-5-7-8-9-10-11-12-22-13-15-23(16-14-22)24-17-19-25(20-18-24)26(3,4)21-6-2/h13-16,24-25H,5-12,17-21H2,1-4H3/q+1/t24-,25-
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8.00E+3n/an/an/an/an/an/an/an/a



Virginia Tech

Curated by ChEMBL


Assay Description
Inhibition of mouse SphK2 expressed in baculovirus infected Sf9 insect cells using sphingosine and [gamma-(32)P]-ATP by scintillation proximity assay


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50359976
PNG
(CHEMBL1927588)
Show SMILES CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)C
Show InChI InChI=1S/C23H40N/c1-5-6-7-8-9-10-11-20-12-14-21(15-13-20)22-16-18-23(19-17-22)24(2,3)4/h12-15,22-23H,5-11,16-19H2,1-4H3/q+1/t22-,23-
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8.00E+3n/an/an/an/an/an/an/an/a



Virginia Tech

Curated by ChEMBL


Assay Description
Inhibition of mouse SphK2 expressed in baculovirus infected Sf9 insect cells using sphingosine and [gamma-(32)P]-ATP by scintillation proximity assay


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343833
PNG
((S)-1-(11-(Cyclohexylmethoxy)undecanoyl)pyrrolidin...)
Show SMILES NC(=N)[C@@H]1CCCN1C(=O)CCCCCCCCCCOCC1CCCCC1
Show InChI InChI=1S/C23H43N3O2/c24-23(25)21-15-12-17-26(21)22(27)16-10-5-3-1-2-4-6-11-18-28-19-20-13-8-7-9-14-20/h20-21H,1-19H2,(H3,24,25)/t21-/m0/s1
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8.00E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241920
PNG
(US9421177, VPC143119)
Show SMILES N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCCc2ccccc2)cc1
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US Patent
>1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241919
PNG
(US9421177, VPC143129)
Show SMILES N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCCCc2ccccc2)cc1
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US Patent
>1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343816
PNG
(1-carbamimidoyl-N-(4-(8-phenyloctyl)phenyl)cyclopr...)
Show SMILES NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCCc2ccccc2)cc1
Show InChI InChI=1S/C25H33N3O/c26-23(27)25(18-19-25)24(29)28-22-16-14-21(15-17-22)13-7-4-2-1-3-6-10-20-11-8-5-9-12-20/h5,8-9,11-12,14-17H,1-4,6-7,10,13,18-19H2,(H3,26,27)(H,28,29)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241911
PNG
(US9421177, VPC171167)
Show SMILES CCCCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O
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US Patent
1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241908
PNG
(US9421177, VPC96055)
Show SMILES CCCCCCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O
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US Patent
1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343826
PNG
(CHEMBL1774568 | N-(1-carbamimidoylcyclopropyl)-4-(...)
Show SMILES CCCCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(N)=N
Show InChI InChI=1S/C22H35N3O2/c1-2-3-4-5-6-7-8-9-10-17-27-19-13-11-18(12-14-19)20(26)25-22(15-16-22)21(23)24/h11-14H,2-10,15-17H2,1H3,(H3,23,24)(H,25,26)
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1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343815
PNG
(1-Carbamimidoyl-N-(4-(9-phenylnonyl)phenyl)cyclopr...)
Show SMILES NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCCCc2ccccc2)cc1
Show InChI InChI=1S/C26H35N3O/c27-24(28)26(19-20-26)25(30)29-23-17-15-22(16-18-23)14-8-5-3-1-2-4-7-11-21-12-9-6-10-13-21/h6,9-10,12-13,15-18H,1-5,7-8,11,14,19-20H2,(H3,27,28)(H,29,30)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343817
PNG
(1-Carbamimidoyl-N-(4-(6-(cyclohexylmethoxy)hexyl)p...)
Show SMILES NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCOCC2CCCCC2)cc1
Show InChI InChI=1S/C24H37N3O2/c25-22(26)24(15-16-24)23(28)27-21-13-11-19(12-14-21)8-4-1-2-7-17-29-18-20-9-5-3-6-10-20/h11-14,20H,1-10,15-18H2,(H3,25,26)(H,27,28)
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1.20E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343827
PNG
(CHEMBL1774569 | N-(1-Carbamimidoylcyclopropyl)-11-...)
Show SMILES NC(=N)C1(CC1)NC(=O)CCCCCCCCCCOCC1CCCCC1
Show InChI InChI=1S/C22H41N3O2/c23-21(24)22(15-16-22)25-20(26)14-10-5-3-1-2-4-6-11-17-27-18-19-12-8-7-9-13-19/h19H,1-18H2,(H3,23,24)(H,25,26)
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1.20E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241921
PNG
(US9421177, VPC143113)
Show SMILES N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCOCC2CCCCC2)cc1
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US Patent
1.20E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50359979
PNG
(CHEMBL1927596)
Show SMILES CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCO
Show InChI InChI=1S/C24H42NO/c1-4-5-6-7-8-9-10-21-11-13-22(14-12-21)23-15-17-24(18-16-23)25(2,3)19-20-26/h11-14,23-24,26H,4-10,15-20H2,1-3H3/q+1/t23-,24-
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1.40E+4n/an/an/an/an/an/an/an/a



Virginia Tech

Curated by ChEMBL


Assay Description
Inhibition of mouse SphK2 expressed in baculovirus infected Sf9 insect cells using sphingosine and [gamma-(32)P]-ATP by scintillation proximity assay


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343823
PNG
(CHEMBL1774565 | N-(1-Carbamimidoylcyclopropyl)-4-(...)
Show SMILES NC(=N)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1
Show InChI InChI=1S/C25H39N3O2/c26-24(27)25(16-17-25)28-23(29)22-14-12-20(13-15-22)9-5-2-1-3-8-18-30-19-21-10-6-4-7-11-21/h12-15,21H,1-11,16-19H2,(H3,26,27)(H,28,29)
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1.50E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241927
PNG
(US9421177, VPC14a1051)
Show SMILES N\C(=N/O)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1
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US Patent
1.50E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241939
PNG
(US9421177, VPC143237)
Show SMILES N\C(=N/O)[C@@H]1CCCN1C(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1
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US Patent
1.50E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343824
PNG
(CHEMBL1774566 | N-(1-Carbamimidoylcyclopropyl)-4-(...)
Show SMILES NC(=N)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCC2)cc1
Show InChI InChI=1S/C24H37N3O2/c25-23(26)24(15-16-24)27-22(28)21-13-11-19(12-14-21)8-4-2-1-3-7-17-29-18-20-9-5-6-10-20/h11-14,20H,1-10,15-18H2,(H3,25,26)(H,27,28)
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1.80E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241926
PNG
(US9421177, VPC143154)
Show SMILES N\C(=N/O)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCC2)cc1
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US Patent
1.80E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343834
PNG
((S)-1-(4-(4-(3-(2-Cyclohexylethyl)phenyl)-1H-imida...)
Show SMILES NC(=N)[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1nc(c[nH]1)-c1cccc(CCC2CCCCC2)c1
Show InChI InChI=1S/C29H35N5O/c30-27(31)26-10-5-17-34(26)29(35)23-15-13-22(14-16-23)28-32-19-25(33-28)24-9-4-8-21(18-24)12-11-20-6-2-1-3-7-20/h4,8-9,13-16,18-20,26H,1-3,5-7,10-12,17H2,(H3,30,31)(H,32,33)/t26-/m0/s1
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2.00E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241910
PNG
(US9421177, VPC171147)
Show SMILES CCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O
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US Patent
2.00E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241923
PNG
(US9421177, VPC143126)
Show SMILES N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCCOCC2CCCCC2)cc1
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US Patent
>2.00E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343819
PNG
(1-Carbamimidoyl-N-(4-(8-(cyclohexylmethoxy)octyl)p...)
Show SMILES NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCCOCC2CCCCC2)cc1
Show InChI InChI=1S/C26H41N3O2/c27-24(28)26(17-18-26)25(30)29-23-15-13-21(14-16-23)10-6-3-1-2-4-9-19-31-20-22-11-7-5-8-12-22/h13-16,22H,1-12,17-20H2,(H3,27,28)(H,29,30)
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>2.00E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241904
PNG
(US9421177, VPC96031)
Show SMILES CCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O
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US Patent
2.30E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM241925
PNG
(US9421177, VPC14a1058)
Show SMILES N\C(=N/O)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCC1
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US Patent
2.50E+4n/an/an/an/an/an/an/an/a



University of Virginia Patent Foundation

US Patent


Assay Description
Sphingosine kinase activity was assessed as described previously (Kharel, Y., Lee, S., Snyder, A. H., Sheasley-O'Neill, S. L., Morris, M. A., Set...


US Patent US9421177 (2016)

More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343822
PNG
(1-carbamimidoyl-N-(10-(cyclopentylmethoxy)decyl)cy...)
Show SMILES NC(=N)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCC1
Show InChI InChI=1S/C21H39N3O2/c22-19(23)21(13-14-21)20(25)24-15-9-5-3-1-2-4-6-10-16-26-17-18-11-7-8-12-18/h18H,1-17H2,(H3,22,23)(H,24,25)
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2.50E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Sphingosine kinase 2 (SPHK2)


(Mus musculus (Mouse))
BDBM50343821
PNG
(1-Carbamimidoyl-N-(10-(cyclohexylmethoxy)decyl)cyc...)
Show SMILES NC(=N)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCCC1
Show InChI InChI=1S/C22H41N3O2/c23-20(24)22(14-15-22)21(26)25-16-10-5-3-1-2-4-6-11-17-27-18-19-12-8-7-9-13-19/h19H,1-18H2,(H3,23,24)(H,25,26)
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2.60E+4n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant SPHK2 expressed in baculovirus-infected Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
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