BindingDB logo
myBDB logout

PubMed code 26383127

Compile data set for download or QSAR
Found 13 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
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Homo sapiens (Human))
BDBM50143320
PNG
((+)-epibatidine | (-)-1-epidatidine | (1S,2S,4R)-2...)
Show SMILES Clc1ccc(cn1)[C@@H]1C[C@H]2CC[C@@H]1N2 |THB:4:7:13:11.10|
Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8-,9+,10+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.0450n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Binding affinity to alpha4beta2 nAChR (unknown origin)


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127648
PNG
(CHEMBL3628495)
Show SMILES Clc1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C10H12ClN3/c11-7-1-10(4-12-3-7)14-5-8-2-9(6-14)13-8/h1,3-4,8-9,13H,2,5-6H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
73n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127655
PNG
(CHEMBL3628496)
Show SMILES Brc1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C10H12BrN3/c11-7-1-10(4-12-3-7)14-5-8-2-9(6-14)13-8/h1,3-4,8-9,13H,2,5-6H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
176n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127663
PNG
(CHEMBL3628504)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H16N4O2/c21-20(22)15-3-1-11(2-4-15)12-5-16(8-17-7-12)19-9-13-6-14(10-19)18-13/h1-5,7-8,13-14,18H,6,9-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.00E+3n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127662
PNG
(CHEMBL3628503)
Show SMILES Clc1ccc(Cl)c(c1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H15Cl2N3/c17-11-1-2-16(18)15(4-11)10-3-14(7-19-6-10)21-8-12-5-13(9-21)20-12/h1-4,6-7,12-13,20H,5,8-9H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
6.00E+3n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127665
PNG
(CHEMBL3628506)
Show SMILES COc1ccc(cc1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C17H19N3O/c1-21-17-4-2-12(3-5-17)13-6-16(9-18-8-13)20-10-14-7-15(11-20)19-14/h2-6,8-9,14-15,19H,7,10-11H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
6.50E+3n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127660
PNG
(CHEMBL3628501)
Show SMILES Clc1ccc(c(Cl)c1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H15Cl2N3/c17-11-1-2-15(16(18)4-11)10-3-14(7-19-6-10)21-8-12-5-13(9-21)20-12/h1-4,6-7,12-13,20H,5,8-9H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.30E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127656
PNG
(CHEMBL3628497)
Show SMILES C1C2CN(CC1N2)c1cncc(c1)-c1ccccc1
Show InChI InChI=1S/C16H17N3/c1-2-4-12(5-3-1)13-6-16(9-17-8-13)19-10-14-7-15(11-19)18-14/h1-6,8-9,14-15,18H,7,10-11H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.70E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127659
PNG
(CHEMBL3628500)
Show SMILES Brc1ccc(cc1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H16BrN3/c17-13-3-1-11(2-4-13)12-5-16(8-18-7-12)20-9-14-6-15(10-20)19-14/h1-5,7-8,14-15,19H,6,9-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
3.40E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127661
PNG
(CHEMBL3628502)
Show SMILES Clc1ccc(cc1Cl)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H15Cl2N3/c17-15-2-1-10(4-16(15)18)11-3-14(7-19-6-11)21-8-12-5-13(9-21)20-12/h1-4,6-7,12-13,20H,5,8-9H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
3.60E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127657
PNG
(CHEMBL3628498)
Show SMILES Clc1ccc(cc1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H16ClN3/c17-13-3-1-11(2-4-13)12-5-16(8-18-7-12)20-9-14-6-15(10-20)19-14/h1-5,7-8,14-15,19H,6,9-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.80E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127664
PNG
(CHEMBL3628505)
Show SMILES Cc1ccc(cc1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C17H19N3/c1-12-2-4-13(5-3-12)14-6-17(9-18-8-14)20-10-15-7-16(11-20)19-15/h2-6,8-9,15-16,19H,7,10-11H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.60E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50127658
PNG
(CHEMBL3628499)
Show SMILES Fc1ccc(cc1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H16FN3/c17-13-3-1-11(2-4-13)12-5-16(8-18-7-12)20-9-14-6-15(10-20)19-14/h1-5,7-8,14-15,19H,6,9-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.10E+5n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%