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There are 20 purchasable compounds for target: Lymphocyte differentiation antigen CD38

Compile data set for download or QSAR
Wt: 286.2
BDBM7459
Purchase
Wt: 302.2
BDBM7460
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Wt: 318.2
BDBM15236
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Wt: 318.2
BDBM23408
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Wt: 290.2
BDBM23416
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Wt: 228.2
BDBM23926
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Wt: 302.2
BDBM50033767
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Wt: 244.2
BDBM50045936
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Wt: 304.2
BDBM50049400
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Wt: 262.7
BDBM50178766
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Wt: 214.2
BDBM50178767
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Wt: 248.7
BDBM50178769
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Wt: 228.2
BDBM50178773
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Wt: 271.2
BDBM50326998
Purchase
Wt: 303.2
BDBM50326997
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Displayed 1 to 15 (of 20 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 7459,7460,15236,23408,23416,23926,50033767,50045936,50049400,50178766,50178767,50178769,50178773,50326998,50326997   
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
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50178767
PNG
(2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide | CH...)
Show SMILES NC(=O)C1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1S/C13H14N2O/c14-13(16)10-6-3-5-9-8-4-1-2-7-11(8)15-12(9)10/h1-2,4,7,10,15H,3,5-6H2,(H2,14,16)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Elixir Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against pig brain NAD glycohydrolase (NADase) by radiochemical Nicotinamide release assay


J Med Chem 48: 8045-54 (2005)


Article DOI: 10.1021/jm050522v
BindingDB Entry DOI: 10.7270/Q27D2TPK
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM23416
PNG
(α-CA inhibitor, 3 | (+)-Catechin | (2R,3S)-2-...)
Show SMILES O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50178773
PNG
(6-methyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxa...)
Show SMILES Cc1ccc2[nH]c3C(CCCc3c2c1)C(N)=O
Show InChI InChI=1S/C14H16N2O/c1-8-5-6-12-11(7-8)9-3-2-4-10(14(15)17)13(9)16-12/h5-7,10,16H,2-4H2,1H3,(H2,15,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Elixir Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against pig brain NAD glycohydrolase (NADase) by radiochemical Nicotinamide release assay


J Med Chem 48: 8045-54 (2005)


Article DOI: 10.1021/jm050522v
BindingDB Entry DOI: 10.7270/Q27D2TPK
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50178769
PNG
((+/-)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-c...)
Show SMILES NC(=O)C1CCCc2c1[nH]c1ccc(Cl)cc21
Show InChI InChI=1S/C13H13ClN2O/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(15)17)12(8)16-11/h4-6,9,16H,1-3H2,(H2,15,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Elixir Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against pig brain NAD glycohydrolase (NADase) by radiochemical Nicotinamide release assay


J Med Chem 48: 8045-54 (2005)


Article DOI: 10.1021/jm050522v
BindingDB Entry DOI: 10.7270/Q27D2TPK
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50326997
PNG
(CHEMBL590878 | DELPHINIDIN | Delphinidin)
Show SMILES Oc1cc2oc(c(O)cc2c(=[OH+])c1)-c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C15H10O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-5,16,18-21H/p+1
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n/an/a 1.46E+4n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50326998
PNG
(CHEMBL591036 | PELARGONIDIN | Pelargonidin)
Show SMILES Oc1ccc(cc1)-c1oc2cc(O)cc(=[OH+])c2cc1O
Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7,16-17,19H/p+1
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n/an/a 1.63E+4n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM15236
PNG
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H
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n/an/a 2.48E+4n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 3.79E+4n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50033767
PNG
(3,3',4',5',7-pentahydroxy flavone | 3,7,3',4',5'-P...)
Show SMILES Oc1ccc2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-1-2-8-11(5-7)22-15(14(21)12(8)19)6-3-9(17)13(20)10(18)4-6/h1-5,16-18,20-21H
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n/an/a 3.79E+4n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM23408
PNG
(2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4H-ch...)
Show SMILES Oc1ccc(cc1O)-c1oc2cc(O)c(O)c(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)15-14(22)13(21)10-9(23-15)4-8(18)11(19)12(10)20/h1-4,16-20,22H
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n/an/a 4.86E+4n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50049400
PNG
((+/-) taxifolin | (+/-)-Dihydroquercetin | (+/-)-t...)
Show SMILES OC1C(=O)C(Oc2cc(O)cc(O)c12)c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,13,15-20H
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n/an/a>1.00E+5n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50045936
PNG
((E)-4-(3,5-dihydroxystyryl)benzene-1,2-diol | (E)-...)
Show SMILES Oc1cc(O)cc(\C=C\c2ccc(O)c(O)c2)c1
Show InChI InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+
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n/an/a>1.00E+5n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM23926
PNG
((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)
Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
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n/an/a>1.00E+5n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM7459
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H
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n/an/a 8.20E+3n/an/an/an/an/an/a



UMR 7200 CNRS-Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Inhibition of human CD38 using 20 uM 1, N6-etheno NAD+ as substrate by continuous fluorimetric method


Bioorg Med Chem Lett 21: 3939-42 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.022
BindingDB Entry DOI: 10.7270/Q2SF2WJX
More data for this
Ligand-Target Pair
Lymphocyte differentiation antigen CD38


(Homo sapiens (Human))
BDBM50178766
PNG
(2-chloro-5,6,7,8,9,10-hexahydrocyclohepta[b]indole...)
Show SMILES NC(=O)C1CCCCc2c1[nH]c1ccc(Cl)cc21
Show InChI InChI=1S/C14H15ClN2O/c15-8-5-6-12-11(7-8)9-3-1-2-4-10(14(16)18)13(9)17-12/h5-7,10,17H,1-4H2,(H2,16,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Elixir Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against pig brain NAD glycohydrolase (NADase) by radiochemical Nicotinamide release assay


J Med Chem 48: 8045-54 (2005)


Article DOI: 10.1021/jm050522v
BindingDB Entry DOI: 10.7270/Q27D2TPK
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 6 hits for monomerid = 7459,7460,15236,23408,23416,23926,50033767,50045936,50049400,50178766,50178767,50178769,50178773,50326998,50326997
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
BDBM7460
JPEG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Serine/threonine-protein kinase PIM

(Homo sapiens (Human))
CHEBI
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PC cid
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PDB
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PDB
-9.78-0.257-9.587.597.510



Oxford University





J Med Chem 48: 7604-14 (2005)

Transcriptional Regulator TtgR

(Pseudomonas putida)
BDBM7460
JPEG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
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-8.080.840-8.925.83730



Estacion Experimental del Zaidin





J Biol Chem 281: 7102-9 (2006)

Transcriptional Regulator TtgR

(Pseudomonas putida)
BDBM7460
JPEG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
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-7.40-2.66-4.745.34730



Estacion Experimental del Zaidin





J Biol Chem 281: 7102-9 (2006)

Quinone Reductase 2 (QR2)

(Homo sapiens (Human))
BDBM23926
JPEG
((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)
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-9.785.00-14.67.417.525



University of Illinois at Chicago





Biochem J 413: 81-91 (2008)

Transcriptional Regulator TtgR

(Pseudomonas putida)
BDBM7459
JPEG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)
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PDB
-7.12-4.08-3.055.14730



Estacion Experimental del Zaidin





J Biol Chem 281: 7102-9 (2006)

Transcriptional Regulator TtgR-DNA

(Pseudomonas putida)
BDBM7460
JPEG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
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CHEBI
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PC cid
PC sid
PDB
-7.94-2.82-5.125.73730



Estacion Experimental del Zaidin





J Biol Chem 281: 7102-9 (2006)