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Found 19 hits Enz. Inhib. hit(s) with Target = 'Phosphatidylcholine:ceramide cholinephosphotransferase 2' AND taxid = 9606   
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
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447010
PNG
(CHEMBL1509437)
Show SMILES COc1ccccc1NC(C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C22H20N2O2/c1-25-22-14-8-6-12-19(22)24-20(15-23)18-11-5-7-13-21(18)26-16-17-9-3-2-4-10-17/h2-14,20,24H,16H2,1H3
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n/an/a 1.24E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447012
PNG
(CHEMBL1446389)
Show SMILES N#CC(Nc1ccccc1)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C21H18N2O/c22-15-20(23-18-11-5-2-6-12-18)19-13-7-8-14-21(19)24-16-17-9-3-1-4-10-17/h1-14,20,23H,16H2
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n/an/a 1.35E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447007
PNG
(CHEMBL3116080)
Show SMILES Clc1ccccc1NC(C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C21H17ClN2O/c22-18-11-5-6-12-19(18)24-20(14-23)17-10-4-7-13-21(17)25-15-16-8-2-1-3-9-16/h1-13,20,24H,15H2
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n/an/a 1.58E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447005
PNG
(CHEMBL3116082)
Show SMILES Oc1ccccc1NC(C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C21H18N2O2/c22-14-19(23-18-11-5-6-12-20(18)24)17-10-4-7-13-21(17)25-15-16-8-2-1-3-9-16/h1-13,19,23-24H,15H2
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n/an/a 1.90E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447003
PNG
(CHEMBL3116084)
Show SMILES N#CC(Nc1ccccc1C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C22H17N3O/c23-14-18-10-4-6-12-20(18)25-21(15-24)19-11-5-7-13-22(19)26-16-17-8-2-1-3-9-17/h1-13,21,25H,16H2
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n/an/a 2.03E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447008
PNG
(CHEMBL1407857)
Show SMILES Cc1ccc(NC(C#N)c2ccccc2OCc2ccccc2)cc1
Show InChI InChI=1S/C22H20N2O/c1-17-11-13-19(14-12-17)24-21(15-23)20-9-5-6-10-22(20)25-16-18-7-3-2-4-8-18/h2-14,21,24H,16H2,1H3
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n/an/a 2.08E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447006
PNG
(CHEMBL3116081)
Show SMILES Clc1ccc(NC(C#N)c2ccccc2OCc2ccccc2)cc1
Show InChI InChI=1S/C21H17ClN2O/c22-17-10-12-18(13-11-17)24-20(14-23)19-8-4-5-9-21(19)25-15-16-6-2-1-3-7-16/h1-13,20,24H,15H2
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n/an/a 2.25E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447004
PNG
(CHEMBL3116083)
Show SMILES Oc1ccc(NC(C#N)c2ccccc2OCc2ccccc2)cc1
Show InChI InChI=1S/C21H18N2O2/c22-14-20(23-17-10-12-18(24)13-11-17)19-8-4-5-9-21(19)25-15-16-6-2-1-3-7-16/h1-13,20,23-24H,15H2
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n/an/a 2.44E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447000
PNG
(CHEMBL3116246)
Show SMILES [O-][N+](=O)c1ccccc1NC(C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C21H17N3O3/c22-14-19(23-18-11-5-6-12-20(18)24(25)26)17-10-4-7-13-21(17)27-15-16-8-2-1-3-9-16/h1-13,19,23H,15H2
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n/an/a 2.74E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447001
PNG
(CHEMBL3116245)
Show SMILES Cc1cccc(C)c1NC(C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C23H22N2O/c1-17-9-8-10-18(2)23(17)25-21(15-24)20-13-6-7-14-22(20)26-16-19-11-4-3-5-12-19/h3-14,21,25H,16H2,1-2H3
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n/an/a 3.15E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50446999
PNG
(CHEMBL3116247)
Show SMILES N#CC(Nc1cccnc1)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C20H17N3O/c21-13-19(23-17-9-6-12-22-14-17)18-10-4-5-11-20(18)24-15-16-7-2-1-3-8-16/h1-12,14,19,23H,15H2
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n/an/a 3.50E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447014
PNG
(CHEMBL1425237)
Show SMILES COc1ccc(NC(C#N)c2ccccc2OCc2ccccc2)cc1
Show InChI InChI=1S/C22H20N2O2/c1-25-19-13-11-18(12-14-19)24-21(15-23)20-9-5-6-10-22(20)26-16-17-7-3-2-4-8-17/h2-14,21,24H,16H2,1H3
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n/an/a 4.81E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447011
PNG
(CHEMBL3116075)
Show SMILES N#CC(Nc1ccccc1)c1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C21H18N2O/c22-15-21(23-19-11-5-2-6-12-19)18-10-7-13-20(14-18)24-16-17-8-3-1-4-9-17/h1-14,21,23H,16H2
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n/an/a 5.07E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447009
PNG
(CHEMBL3116079)
Show SMILES Cc1ccccc1NC(C#N)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C22H20N2O/c1-17-9-5-7-13-20(17)24-21(15-23)19-12-6-8-14-22(19)25-16-18-10-3-2-4-11-18/h2-14,21,24H,16H2,1H3
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n/an/a 6.72E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50446998
PNG
(CHEMBL3116248)
Show SMILES N#CC(NCc1ccco1)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C20H18N2O2/c21-13-19(22-14-17-9-6-12-23-17)18-10-4-5-11-20(18)24-15-16-7-2-1-3-8-16/h1-12,19,22H,14-15H2
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n/an/a 7.10E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447013
PNG
(CHEMBL3116074)
Show SMILES Oc1ccccc1C1Oc2ccccc2C(C#N)N1c1ccccc1
Show InChI InChI=1S/C21H16N2O2/c22-14-18-16-10-5-7-13-20(16)25-21(17-11-4-6-12-19(17)24)23(18)15-8-2-1-3-9-15/h1-13,18,21,24H
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n/an/a 7.50E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50447002
PNG
(CHEMBL3116085)
Show SMILES NC(=O)c1ccc(NC(C#N)c2ccccc2OCc2ccccc2)cc1
Show InChI InChI=1S/C22H19N3O2/c23-14-20(25-18-12-10-17(11-13-18)22(24)26)19-8-4-5-9-21(19)27-15-16-6-2-1-3-7-16/h1-13,20,25H,15H2,(H2,24,26)
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n/an/a 8.05E+4n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50446997
PNG
(CHEMBL3116250)
Show SMILES NC(=O)C(Nc1ccccc1)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C21H20N2O2/c22-21(24)20(23-17-11-5-2-6-12-17)18-13-7-8-14-19(18)25-15-16-9-3-1-4-10-16/h1-14,20,23H,15H2,(H2,22,24)
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n/an/a 1.35E+5n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair
Phosphatidylcholine:ceramide cholinephosphotransferase 2


(Homo sapiens)
BDBM50373123
PNG
(CHEMBL404954)
Show SMILES [S-]C(=S)OC1CC2CC1C1CCCC21
Show InChI InChI=1S/C11H16OS2/c13-11(14)12-10-5-6-4-9(10)8-3-1-2-7(6)8/h6-10H,1-5H2,(H,13,14)/p-1
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n/an/a 2.24E+5n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of SMS2 (unknown origin) expressed in H5 insect cells using C6-NBD-Cer as substrate after 1 hr


Citation and Details
More data for this
Ligand-Target Pair