BindingDB logo
myBDB logout

PubMed code 28539219

Compile data set for download or QSAR
Found 7 hits of Enzyme Inhibition Constant Data   
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
Lysine-specific demethylase 4D


(Homo sapiens (Human))
BDBM50242878
PNG
(CHEMBL4090908)
Show SMILES Cc1nn2c(nc(O)c3cccnc23)c1C#N
Show InChI InChI=1S/C11H7N5O/c1-6-8(5-12)10-14-11(17)7-3-2-4-13-9(7)16(10)15-6/h2-4H,1H3,(H,14,17)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/a 410n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Lysine-specific demethylase 4D


(Homo sapiens (Human))
BDBM50242881
PNG
(CHEMBL4086607)
Show SMILES CCc1nn2c(nc(O)c3cccnc23)c1C#N
Show InChI InChI=1S/C12H9N5O/c1-2-9-8(6-13)11-15-12(18)7-4-3-5-14-10(7)17(11)16-9/h3-5H,2H2,1H3,(H,15,18)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.85E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4D


(Homo sapiens (Human))
BDBM50242880
PNG
(CHEMBL4102450)
Show SMILES Oc1nc2c(cnn2c2c(cccc12)[N+]([O-])=O)C#N
Show InChI InChI=1S/C11H5N5O3/c12-4-6-5-13-15-9-7(11(17)14-10(6)15)2-1-3-8(9)16(18)19/h1-3,5H,(H,14,17)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.14E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4D


(Homo sapiens (Human))
BDBM50242879
PNG
(CHEMBL4068909)
Show SMILES N#Cc1cnn2c1ncc1cccnc21
Show InChI InChI=1S/C10H5N5/c11-4-8-6-14-15-9-7(2-1-3-12-9)5-13-10(8)15/h1-3,5-6H
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.03E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
Lysine-specific demethylase 2B


(Homo sapiens (Human))
BDBM50242878
PNG
(CHEMBL4090908)
Show SMILES Cc1nn2c(nc(O)c3cccnc23)c1C#N
Show InChI InChI=1S/C11H7N5O/c1-6-8(5-12)10-14-11(17)7-3-2-4-13-9(7)16(10)15-6/h2-4H,1H3,(H,14,17)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
Lysine-specific demethylase 3B


(Homo sapiens (Human))
BDBM50242878
PNG
(CHEMBL4090908)
Show SMILES Cc1nn2c(nc(O)c3cccnc23)c1C#N
Show InChI InChI=1S/C11H7N5O/c1-6-8(5-12)10-14-11(17)7-3-2-4-13-9(7)16(10)15-6/h2-4H,1H3,(H,14,17)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM50242878
PNG
(CHEMBL4090908)
Show SMILES Cc1nn2c(nc(O)c3cccnc23)c1C#N
Show InChI InChI=1S/C11H7N5O/c1-6-8(5-12)10-14-11(17)7-3-2-4-13-9(7)16(10)15-6/h2-4H,1H3,(H,14,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Ability to displace [3H]quipazine binding to 5-hydroxytryptamine 3 receptor sites in NG 108-15.


Bioorg Med Chem Lett 27: 3201-3204 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.002
BindingDB Entry DOI: 10.7270/Q2VH5R84
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%