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5 similar compounds to monomer 50440564

Compile data set for download or QSAR
Wt: 419.6
BDBM50143749
Wt: 509.7
BDBM50143758
Wt: 618.8
BDBM50440601
Wt: 438.6
BDBM50440602
Wt: 438.6
BDBM50440604

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 36 hits for monomerid = 50143749,50143758,50440601,50440602,50440604   
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
C-C chemokine receptor type 5


(Homo sapiens (Human))
BDBM50143749
PNG
((4-Benzylamino-4'-methyl-[1,4']bipiperidinyl-1'-yl...)
Show SMILES Cc1cccc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)NCc1ccccc1
Show InChI InChI=1S/C27H37N3O/c1-21-8-7-9-22(2)25(21)26(31)29-18-14-27(3,15-19-29)30-16-12-24(13-17-30)28-20-23-10-5-4-6-11-23/h4-11,24,28H,12-20H2,1-3H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonistic activity against human C-C chemokine receptor type 5.


J Med Chem 47: 1939-55 (2004)


Article DOI: 10.1021/jm031046g
BindingDB Entry DOI: 10.7270/Q2V12478
More data for this
Ligand-Target Pair
Chromobox protein homolog 7 (CBX7)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of CBX7 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
C-C chemokine receptor type 5


(Homo sapiens (Human))
BDBM50143758
PNG
((4-Dibenzylamino-4'-methyl-[1,4']bipiperidinyl-1'-...)
Show SMILES Cc1cccc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C34H43N3O/c1-27-11-10-12-28(2)32(27)33(38)35-23-19-34(3,20-24-35)37-21-17-31(18-22-37)36(25-29-13-6-4-7-14-29)26-30-15-8-5-9-16-30/h4-16,31H,17-26H2,1-3H3
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n/an/a 75n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonistic activity against human C-C chemokine receptor type 5.


J Med Chem 47: 1939-55 (2004)


Article DOI: 10.1021/jm031046g
BindingDB Entry DOI: 10.7270/Q2V12478
More data for this
Ligand-Target Pair
MBT domain-containing protein 1 (MBTD1)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of MBTD1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
MBT domain-containing protein 1 (MBTD1)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of MBTD1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
MBT domain-containing protein 1 (MBTD1)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of MBTD1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a 120n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL3 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL3 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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n/an/a 360n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL3 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a 110n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL3 (unknown origin) using H4K20me2 as substrate after 30 mins by LNCE-TR-FRET assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a 350n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL3 (unknown origin) using H4K20me2 as substrate after 30 mins by LNCE-TR-FRET assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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n/an/a 290n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL3 (unknown origin) using H4K20me2 as substrate after 30 mins by LNCE-TR-FRET assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a 2.20E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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n/an/a 2.80E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Scm-like with four MBT domains protein 1


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of SFMBT1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Scm-like with four MBT domains protein 1


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of SFMBT1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Scm-like with four MBT domains protein 1


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of SFMBT1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 4


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL4 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 4


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL4 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 4


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of L3MBTL4 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of JARID1A (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of JARID1A (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of JARID1A (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
PHD finger protein 23 (PHF23)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of PHF23 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
PHD finger protein 23 (PHF23)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of PHF23 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
PHD finger protein 23 (PHF23)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of PHF23 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase (UHRF1)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of UHRF1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase (UHRF1)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of UHRF1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase (UHRF1)


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of UHRF1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Tumor suppressor p53-binding protein 1


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a 7.90E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of 53BP1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Tumor suppressor p53-binding protein 1


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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n/an/a 4.70E+3n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of 53BP1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Tumor suppressor p53-binding protein 1


(Homo sapiens (Human))
BDBM50440604
PNG
(CHEMBL2426497)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1cccc(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-16-8-23(9-17-29)27-12-1-2-13-27)21-6-5-7-22(20-21)26(32)30-18-10-24(11-19-30)28-14-3-4-15-28/h5-7,20,23-24H,1-4,8-19H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of 53BP1 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Chromobox protein homolog 7 (CBX7)


(Homo sapiens (Human))
BDBM50440601
PNG
(CHEMBL2426480)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(c1)C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C36H54N6O3/c43-34(40-21-9-29(10-22-40)37-15-1-2-16-37)28-7-8-32(35(44)41-23-11-30(12-24-41)38-17-3-4-18-38)33(27-28)36(45)42-25-13-31(14-26-42)39-19-5-6-20-39/h7-8,27,29-31H,1-6,9-26H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of CBX7 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
Chromobox protein homolog 7 (CBX7)


(Homo sapiens (Human))
BDBM50440602
PNG
(CHEMBL2426479)
Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccccc1C(=O)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H38N4O2/c31-25(29-17-9-21(10-18-29)27-13-3-4-14-27)23-7-1-2-8-24(23)26(32)30-19-11-22(12-20-30)28-15-5-6-16-28/h1-2,7-8,21-22H,3-6,9-20H2
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University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Inhibition of CBX7 (unknown origin) after 30 mins by AlphaScreen assay


J Med Chem 56: 7358-71 (2013)


Article DOI: 10.1021/jm400919p
BindingDB Entry DOI: 10.7270/Q2B27WRP
More data for this
Ligand-Target Pair
C-C chemokine receptor type 5


(Homo sapiens (Human))
BDBM50143749
PNG
((4-Benzylamino-4'-methyl-[1,4']bipiperidinyl-1'-yl...)
Show SMILES Cc1cccc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)NCc1ccccc1
Show InChI InChI=1S/C27H37N3O/c1-21-8-7-9-22(2)25(21)26(31)29-18-14-27(3,15-19-29)30-16-12-24(13-17-30)28-20-23-10-5-4-6-11-23/h4-11,24,28H,12-20H2,1-3H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Rises in intracellular [Ca2+] levels by using [Ca2+] sensitive Fluo4 dye in C-C chemokine receptor type 5-transfected CHO cells.


J Med Chem 47: 1939-55 (2004)


Article DOI: 10.1021/jm031046g
BindingDB Entry DOI: 10.7270/Q2V12478
More data for this
Ligand-Target Pair