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Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with all data for entry = 50001377   
Target/Host
(Institution)
LigandTarget/Host
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
Bromodomain adjacent to zinc finger domain protein 2B


(Homo sapiens (Human))
BDBM50277359
PNG
(CHEMBL1612460)
Show SMILES CC(=O)c1cccc(Oc2ncccn2)c1
Show InChI InChI=1S/C12H10N2O2/c1-9(15)10-4-2-5-11(8-10)16-12-13-6-3-7-14-12/h2-8H,1H3
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Article
PubMed
n/an/an/a>5.00E+5n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2B (S2054 to S2168 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
Bromodomain adjacent to zinc finger domain protein 2A


(Homo sapiens (Human))
BDBM50277360
PNG
(CHEMBL4166955)
Show SMILES CCOC(=O)c1cn(C)c(=O)cc1Cl
Show InChI InChI=1S/C9H10ClNO3/c1-3-14-9(13)6-5-11(2)8(12)4-7(6)10/h4-5H,3H2,1-2H3
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n/an/an/a 5.10E+4n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2A (M1792 to L1905 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2B


(Homo sapiens (Human))
BDBM50277366
PNG
(CHEMBL4171398)
Show SMILES CCC(=O)c1c[nH]c(c1)C(=O)OC
Show InChI InChI=1S/C9H11NO3/c1-3-8(11)6-4-7(10-5-6)9(12)13-2/h4-5,10H,3H2,1-2H3
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B.MOAD
antibodypedia
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Article
PubMed
n/an/an/a 5.40E+4n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2B (S2054 to S2168 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2A


(Homo sapiens (Human))
BDBM50277359
PNG
(CHEMBL1612460)
Show SMILES CC(=O)c1cccc(Oc2ncccn2)c1
Show InChI InChI=1S/C12H10N2O2/c1-9(15)10-4-2-5-11(8-10)16-12-13-6-3-7-14-12/h2-8H,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a>5.00E+5n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2A (M1792 to L1905 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2B


(Homo sapiens (Human))
BDBM50277360
PNG
(CHEMBL4166955)
Show SMILES CCOC(=O)c1cn(C)c(=O)cc1Cl
Show InChI InChI=1S/C9H10ClNO3/c1-3-14-9(13)6-5-11(2)8(12)4-7(6)10/h4-5H,3H2,1-2H3
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antibodypedia
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Article
PubMed
n/an/an/a 8.70E+4n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2B (S2054 to S2168 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2A


(Homo sapiens (Human))
BDBM50277367
PNG
(CHEMBL4163507)
Show SMILES CNC(=O)c1cc(Cl)ccn1
Show InChI InChI=1S/C7H7ClN2O/c1-9-7(11)6-4-5(8)2-3-10-6/h2-4H,1H3,(H,9,11)
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PubMed
n/an/an/a>5.00E+5n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2A (M1792 to L1905 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2B


(Homo sapiens (Human))
BDBM50277367
PNG
(CHEMBL4163507)
Show SMILES CNC(=O)c1cc(Cl)ccn1
Show InChI InChI=1S/C7H7ClN2O/c1-9-7(11)6-4-5(8)2-3-10-6/h2-4H,1H3,(H,9,11)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
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MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/an/a>5.00E+5n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2B (S2054 to S2168 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bromodomain adjacent to zinc finger domain protein 2A


(Homo sapiens (Human))
BDBM50277366
PNG
(CHEMBL4171398)
Show SMILES CCC(=O)c1c[nH]c(c1)C(=O)OC
Show InChI InChI=1S/C9H11NO3/c1-3-8(11)6-4-7(10-5-6)9(12)13-2/h4-5,10H,3H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/a 1.00E+5n/an/an/an/an/a



University of Z£rich

Curated by ChEMBL


Assay Description
Binding affinity to human BAZ2A (M1792 to L1905 residues) expressed in bacterial expression system by BROMOscan assay


Eur J Med Chem 139: 564-572 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.028
BindingDB Entry DOI: 10.7270/Q2833VJS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)