BindingDB logo
myBDB logout

5 similar compounds to monomer 50142815

Compile data set for download or QSAR
Wt: 298.3
BDBM50083187
Purchase
Wt: 272.3
BDBM50105637
Wt: 286.3
BDBM50105639
Wt: 300.3
BDBM50105645
Wt: 258.3
BDBM50105651

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 50083187,50105637,50105639,50105645,50105651   
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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50083187
PNG
(1H-Benzoimidazole-4-carboxylic acid (9-methyl-9-az...)
Show SMILES CN1C2CCCC1CC(C2)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
6.10n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro displacement of [3H]-LY 278584 from rat cerebral cortex 5-hydroxytryptamine 3 receptor


Bioorg Med Chem Lett 6: 1195-1198 (1996)


Article DOI: 10.1016/0960-894X(96)00200-4
BindingDB Entry DOI: 10.7270/Q23J3DGF
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50105651
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-methyl-pipe...)
Show SMILES CN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C14H18N4O/c1-18-7-5-10(6-8-18)17-14(19)11-3-2-4-12-13(11)16-9-15-12/h2-4,9-10H,5-8H2,1H3,(H,15,16)(H,17,19)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
145n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro displacement of [3H]-LY 278584 from rat cerebral cortex 5-hydroxytryptamine 3 receptor


Bioorg Med Chem Lett 6: 1195-1198 (1996)


Article DOI: 10.1016/0960-894X(96)00200-4
BindingDB Entry DOI: 10.7270/Q23J3DGF
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50083187
PNG
(1H-Benzoimidazole-4-carboxylic acid (9-methyl-9-az...)
Show SMILES CN1C2CCCC1CC(C2)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
230n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro affinity at serotonergic 5-hydroxytryptamine 3 receptor by radioligand binding assay, using [3H]-LY 278584 in rat cerebral cortex membranes.


J Med Chem 42: 5020-8 (2000)


Article DOI: 10.1021/jm991076c
BindingDB Entry DOI: 10.7270/Q2H132PJ
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50083187
PNG
(1H-Benzoimidazole-4-carboxylic acid (9-methyl-9-az...)
Show SMILES CN1C2CCCC1CC(C2)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
230n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro affinity at serotonergic 5-hydroxytryptamine 3 receptor by radioligand binding assay, using [3H]-LY 278584 in rat cerebral cortex membranes.


J Med Chem 42: 5020-8 (2000)


Article DOI: 10.1021/jm991076c
BindingDB Entry DOI: 10.7270/Q2H132PJ
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105645
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-butyl-piper...)
Show SMILES CCCCN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C17H24N4O/c1-2-3-9-21-10-7-13(8-11-21)20-17(22)14-5-4-6-15-16(14)19-12-18-15/h4-6,12-13H,2-3,7-11H2,1H3,(H,18,19)(H,20,22)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
290n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 4 receptor using [3H]-GR-113,808 as radioligand in rat striatum membrane


J Med Chem 45: 4806-15 (2002)


Article DOI: 10.1021/jm020807x
BindingDB Entry DOI: 10.7270/Q2BZ65D3
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105645
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-butyl-piper...)
Show SMILES CCCCN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C17H24N4O/c1-2-3-9-21-10-7-13(8-11-21)20-17(22)14-5-4-6-15-16(14)19-12-18-15/h4-6,12-13H,2-3,7-11H2,1H3,(H,18,19)(H,20,22)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
290n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro binding affinity to 5-hydroxytryptamine 4 receptor in rat striatum membrane


Bioorg Med Chem Lett 11: 2807-11 (2001)

Checked by Author
Article DOI: 10.1016/s0960-894x(01)00517-0
BindingDB Entry DOI: 10.7270/Q29G5M3X
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105651
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-methyl-pipe...)
Show SMILES CN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C14H18N4O/c1-18-7-5-10(6-8-18)17-14(19)11-3-2-4-12-13(11)16-9-15-12/h2-4,9-10H,5-8H2,1H3,(H,15,16)(H,17,19)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
719n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]GR-113808 from rat striatum 5-hydroxytryptamine 4 receptor


Bioorg Med Chem Lett 6: 1195-1198 (1996)


Article DOI: 10.1016/0960-894X(96)00200-4
BindingDB Entry DOI: 10.7270/Q23J3DGF
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105651
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-methyl-pipe...)
Show SMILES CN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C14H18N4O/c1-18-7-5-10(6-8-18)17-14(19)11-3-2-4-12-13(11)16-9-15-12/h2-4,9-10H,5-8H2,1H3,(H,15,16)(H,17,19)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
719n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro binding affinity to 5-hydroxytryptamine 4 receptor in rat striatum membrane


Bioorg Med Chem Lett 11: 2807-11 (2001)

Checked by Author
Article DOI: 10.1016/s0960-894x(01)00517-0
BindingDB Entry DOI: 10.7270/Q29G5M3X
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105651
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-methyl-pipe...)
Show SMILES CN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C14H18N4O/c1-18-7-5-10(6-8-18)17-14(19)11-3-2-4-12-13(11)16-9-15-12/h2-4,9-10H,5-8H2,1H3,(H,15,16)(H,17,19)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
719n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 4 receptor using [3H]-GR-113,808 as radioligand in rat striatum membrane


J Med Chem 45: 4806-15 (2002)


Article DOI: 10.1021/jm020807x
BindingDB Entry DOI: 10.7270/Q2BZ65D3
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50083187
PNG
(1H-Benzoimidazole-4-carboxylic acid (9-methyl-9-az...)
Show SMILES CN1C2CCCC1CC(C2)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)
UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro affinity at serotonergic 5-hydroxytryptamine 4 receptor by radioligand binding assay using [3H]GR-113808 in rat striatum membranes.


J Med Chem 42: 5020-8 (2000)


Article DOI: 10.1021/jm991076c
BindingDB Entry DOI: 10.7270/Q2H132PJ
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50083187
PNG
(1H-Benzoimidazole-4-carboxylic acid (9-methyl-9-az...)
Show SMILES CN1C2CCCC1CC(C2)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)
UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
>1.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]GR-113808 from rat striatum 5-hydroxytryptamine 4 receptor


Bioorg Med Chem Lett 6: 1195-1198 (1996)


Article DOI: 10.1016/0960-894X(96)00200-4
BindingDB Entry DOI: 10.7270/Q23J3DGF
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105637
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-ethyl-piper...)
Show SMILES CCN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C15H20N4O/c1-2-19-8-6-11(7-9-19)18-15(20)12-4-3-5-13-14(12)17-10-16-13/h3-5,10-11H,2,6-9H2,1H3,(H,16,17)(H,18,20)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 4 receptor using [3H]-GR-113,808 as radioligand in rat striatum membrane


J Med Chem 45: 4806-15 (2002)


Article DOI: 10.1021/jm020807x
BindingDB Entry DOI: 10.7270/Q2BZ65D3
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105639
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-propyl-pipe...)
Show SMILES CCCN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C16H22N4O/c1-2-8-20-9-6-12(7-10-20)19-16(21)13-4-3-5-14-15(13)18-11-17-14/h3-5,11-12H,2,6-10H2,1H3,(H,17,18)(H,19,21)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 4 receptor using [3H]-GR-113,808 as radioligand in rat striatum membrane


J Med Chem 45: 4806-15 (2002)


Article DOI: 10.1021/jm020807x
BindingDB Entry DOI: 10.7270/Q2BZ65D3
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105639
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-propyl-pipe...)
Show SMILES CCCN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C16H22N4O/c1-2-8-20-9-6-12(7-10-20)19-16(21)13-4-3-5-14-15(13)18-11-17-14/h3-5,11-12H,2,6-10H2,1H3,(H,17,18)(H,19,21)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro binding affinity to 5-hydroxytryptamine 4 receptor in rat striatum membrane


Bioorg Med Chem Lett 11: 2807-11 (2001)

Checked by Author
Article DOI: 10.1016/s0960-894x(01)00517-0
BindingDB Entry DOI: 10.7270/Q29G5M3X
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50105637
PNG
(1H-Benzoimidazole-4-carboxylic acid (1-ethyl-piper...)
Show SMILES CCN1CCC(CC1)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1S/C15H20N4O/c1-2-19-8-6-11(7-9-19)18-15(20)12-4-3-5-13-14(12)17-10-16-13/h3-5,10-11H,2,6-9H2,1H3,(H,16,17)(H,18,20)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro binding affinity to 5-hydroxytryptamine 4 receptor in rat striatum membrane


Bioorg Med Chem Lett 11: 2807-11 (2001)

Checked by Author
Article DOI: 10.1016/s0960-894x(01)00517-0
BindingDB Entry DOI: 10.7270/Q29G5M3X
More data for this
Ligand-Target Pair
HTR4


(RAT)
BDBM50083187
PNG
(1H-Benzoimidazole-4-carboxylic acid (9-methyl-9-az...)
Show SMILES CN1C2CCCC1CC(C2)NC(=O)c1cccc2nc[nH]c12
Show InChI InChI=1/C17H22N4O/c1-21-12-4-2-5-13(21)9-11(8-12)20-17(22)14-6-3-7-15-16(14)19-10-18-15/h3,6-7,10-13H,2,4-5,8-9H2,1H3,(H,18,19)(H,20,22)
UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

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



Universidad Complutense

Curated by ChEMBL


Assay Description
In vitro affinity at serotonergic 5-hydroxytryptamine 4 receptor by radioligand binding assay using [3H]GR-113808 in rat striatum membranes.


J Med Chem 42: 5020-8 (2000)


Article DOI: 10.1021/jm991076c
BindingDB Entry DOI: 10.7270/Q2H132PJ
More data for this
Ligand-Target Pair