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7 similar compounds to monomer 50455966

Compile data set for download or QSAR
Wt: 435.4
BDBM50455958
Wt: 447.4
BDBM50455962
Wt: 395.9
BDBM50455970
Wt: 409.9
BDBM50455964
Wt: 461.5
BDBM50455967
Wt: 463.5
BDBM50455978
Wt: 473.5
BDBM50455971

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50455958,50455962,50455970,50455964,50455967,50455978,50455971   
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)
BDBM50455958
PNG
(CHEMBL39479)
Show SMILES CCCOc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C
Show InChI InChI=1S/C19H27N3O3.C2H2O4/c1-3-10-25-17-7-5-4-6-16(17)18(23)21-19(24)20-13-11-14-8-9-15(12-13)22(14)2;3-1(4)2(5)6/h4-7,13-15H,3,8-12H2,1-2H3,(H2,20,21,23,24);(H,3,4)(H,5,6)
PDB

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PC cid
PC sid
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Article
PubMed
n/an/an/a 1.30n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50455962
PNG
(CHEMBL36157)
Show SMILES CCOc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C
Show InChI InChI=1S/C18H25N3O3.C4H4O4/c1-3-24-16-7-5-4-6-15(16)17(22)20-18(23)19-12-10-13-8-9-14(11-12)21(13)2;5-3(6)1-2-4(7)8/h4-7,12-14H,3,8-11H2,1-2H3,(H2,19,20,22,23);1-2H,(H,5,6)(H,7,8)/b;2-1+
PDB

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PC sid
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PubMed
n/an/an/a 2n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50455964
PNG
(CHEMBL542090)
Show SMILES CCCCCOc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C
Show InChI InChI=1S/C21H31N3O3.ClH/c1-3-4-7-12-27-19-9-6-5-8-18(19)20(25)23-21(26)22-15-13-16-10-11-17(14-15)24(16)2;/h5-6,8-9,15-17H,3-4,7,10-14H2,1-2H3,(H2,22,23,25,26);1H
PDB

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n/an/an/a 32n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50455978
PNG
(CHEMBL39934)
Show SMILES CC(C)CCOc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C
Show InChI InChI=1S/C21H31N3O3.C2H2O4/c1-14(2)10-11-27-19-7-5-4-6-18(19)20(25)23-21(26)22-15-12-16-8-9-17(13-15)24(16)3;3-1(4)2(5)6/h4-7,14-17H,8-13H2,1-3H3,(H2,22,23,25,26);(H,3,4)(H,5,6)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/a 6.30n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50455970
PNG
(CHEMBL544002)
Show SMILES CCCCOc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C
Show InChI InChI=1S/C20H29N3O3.ClH/c1-3-4-11-26-18-8-6-5-7-17(18)19(24)22-20(25)21-14-12-15-9-10-16(13-14)23(15)2;/h5-8,14-16H,3-4,9-13H2,1-2H3,(H2,21,22,24,25);1H
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 2n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50455971
PNG
(CHEMBL289115)
Show SMILES CN1C2CCC1CC(C2)NC(=O)NC(=O)c1ccccc1OCC1CC1
Show InChI InChI=1S/C20H27N3O3.C4H4O4/c1-23-15-8-9-16(23)11-14(10-15)21-20(25)22-19(24)17-4-2-3-5-18(17)26-12-13-6-7-13;5-3(6)1-2-4(7)8/h2-5,13-16H,6-12H2,1H3,(H2,21,22,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 1.30n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50455967
PNG
(CHEMBL37239)
Show SMILES CC(C)Oc1ccccc1C(=O)NC(=O)NC1CC2CCC(C1)N2C
Show InChI InChI=1S/C19H27N3O3.C4H4O4/c1-12(2)25-17-7-5-4-6-16(17)18(23)21-19(24)20-13-10-14-8-9-15(11-13)22(14)3;5-3(6)1-2-4(7)8/h4-7,12-15H,8-11H2,1-3H3,(H2,20,21,23,24);1-2H,(H,5,6)(H,7,8)/b;2-1-
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 0.631n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro antagonism of the 5-HT-3 receptor determined by inhibition of 5-HT-induced depolarization of the isolated rat vagus nerve.


J Med Chem 35: 1515-20 (1992)


Article DOI: 10.1021/jm00087a003
BindingDB Entry DOI: 10.7270/Q24B32SK
More data for this
Ligand-Target Pair