BindingDB logo
myBDB logout

PubMed code 15013010

Compile data set for download or QSAR
Found 9 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
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50108307
PNG
(1,2,3,4-Tetrahydro-pyrazino[1,2-a]indole | CHEMBL6...)
Show SMILES C1Cn2c(CN1)cc1ccccc21
Show InChI InChI=1S/C11H12N2/c1-2-4-11-9(3-1)7-10-8-12-5-6-13(10)11/h1-4,7,12H,5-6,8H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 516n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50130262
PNG
(2,3,4,9-Tetrahydro-1H-beta-carboline | CHEMBL26923...)
Show SMILES C1Cc2c(CN1)[nH]c1ccccc21
Show InChI InChI=1S/C11H12N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-4,12-13H,5-7H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents

Similars
Article
PubMed
 1.60E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50223742
PNG
(CHEMBL267399)
Show SMILES C1CN2CCc3c([nH]c4ccccc34)C2=N1 |c:17|
Show InChI InChI=1S/C13H13N3/c1-2-4-11-9(3-1)10-5-7-16-8-6-14-13(16)12(10)15-11/h1-4,15H,5-8H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 1.60E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50130262
PNG
(2,3,4,9-Tetrahydro-1H-beta-carboline | CHEMBL26923...)
Show SMILES C1Cc2c(CN1)[nH]c1ccccc21
Show InChI InChI=1S/C11H12N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-4,12-13H,5-7H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents

Similars
Article
PubMed
 3.80E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 2A receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50086502
PNG
(2-BFi | 2-Benzofuran-2-yl-4,5-dihydro-1H-imidazole...)
Show SMILES C1CN=C(N1)c1cc2ccccc2o1 |c:2|
Show InChI InChI=1S/C11H10N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-4,7H,5-6H2,(H,12,13)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 4.00E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50108311
PNG
(7-Methoxy-1,2,3,4-tetrahydro-pyrazino[1,2-a]indole...)
Show SMILES COc1ccc2cc3CNCCn3c2c1
Show InChI InChI=1S/C12H14N2O/c1-15-11-3-2-9-6-10-8-13-4-5-14(10)12(9)7-11/h2-3,6-7,13H,4-5,8H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 4.51E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50108316
PNG
(8-Methoxy-1,2,3,4-tetrahydro-pyrazino[1,2-a]indole...)
Show SMILES COc1ccc2n3CCNCc3cc2c1
Show InChI InChI=1S/C12H14N2O/c1-15-11-2-3-12-9(7-11)6-10-8-13-4-5-14(10)12/h2-3,6-7,13H,4-5,8H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 9.55E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50108316
PNG
(8-Methoxy-1,2,3,4-tetrahydro-pyrazino[1,2-a]indole...)
Show SMILES COc1ccc2n3CCNCc3cc2c1
Show InChI InChI=1S/C12H14N2O/c1-15-11-2-3-12-9(7-11)6-10-8-13-4-5-14(10)12/h2-3,6-7,13H,4-5,8H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 9.93E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 2A serotonin receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))		BDBM50108305
PNG
(1,2,3,4-Tetrahydro-benzo[4,5]imidazo[1,2-a]pyrazin...)
Show SMILES C1Cn2c(CN1)nc1ccccc21
Show InChI InChI=1S/C10H11N3/c1-2-4-9-8(3-1)12-10-7-11-5-6-13(9)10/h1-4,11H,5-7H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents
Article
PubMed
 1.34E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H]RX-821002 from alpha-2 adrenergic receptor

Bioorg Med Chem Lett 14: 1003-5 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.033
BindingDB Entry DOI: 10.7270/Q2NK3DGR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%