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Compile Data Set for Download or QSAR

Found 208 hits with Last Name = 'skorupska' and Initial = 'm'   
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
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM85330
PNG
(CAS_68647 | NSC_68647 | ONDANSETRON | Ondansetron ...)
Show SMILES Cc1nccn1CC1CCc2c(C1=O)c1ccccc1n2C
Show InChI InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3
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1.20n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50014407
PNG
(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
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1.20n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031932
PNG
(7-(4-Methyl-piperazin-1-yl)-6H-5-oxa-8-aza-benzo[c...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C21H21N3O/c1-23-10-12-24(13-11-23)21-17-14-25-19-9-5-3-7-16(19)20(17)15-6-2-4-8-18(15)22-21/h2-9H,10-14H2,1H3
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1.60n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031942
PNG
((6aR,9R)-4,6a,7-Trimethyl-4,6,6a,7,8,9-hexahydro-i...)
Show SMILES CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3cn(C)c4cccc(C2=C1)c34 |r,c:24|
Show InChI InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15+,19-/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50029150
PNG
(3-(2-Piperidin-4-yl-ethyl)-1H-indole | CHEMBL27652...)
Show SMILES C(Cc1c[nH]c2ccccc12)C1CCNCC1
Show InChI InChI=1S/C15H20N2/c1-2-4-15-14(3-1)13(11-17-15)6-5-12-7-9-16-10-8-12/h1-4,11-12,16-17H,5-10H2
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2n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Effect of compound on Serotonin transporter uptake from rat cortex using [3H]citalopram as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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2.10n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 1A receptor from rat hippocampus using [3H]8-OH-DPAT as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 1B


(Rattus norvegicus (Rat))
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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2.5n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 1B receptor from rat striatum using [3H]5-HT as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031925
PNG
(6-(4-Methyl-piperazin-1-yl)-7,8-dihydro-benzo[k]ph...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C22H23N3/c1-24-12-14-25(15-13-24)22-19-11-10-16-6-2-3-7-17(16)21(19)18-8-4-5-9-20(18)23-22/h2-9H,10-15H2,1H3
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3.5n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031939
PNG
(6-(4-Methyl-piperazin-1-yl)-7,8-dihydro-9-oxa-5-az...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1CCOc1ccccc-21
Show InChI InChI=1S/C22H23N3O/c1-24-11-13-25(14-12-24)22-18-10-15-26-20-9-5-3-7-17(20)21(18)16-6-2-4-8-19(16)23-22/h2-9H,10-15H2,1H3
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3.80n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Rattus norvegicus (Rat))
BDBM50451023
PNG
(MESULERGINE)
Show SMILES [H][C@@]12Cc3cn(C)c4cccc(c34)[C@@]1([H])C[C@H](CNS(=O)(=O)N(C)C)CN2C |r|
Show InChI InChI=1S/C19H28N4O2S/c1-21(2)26(24,25)20-10-13-8-16-15-6-5-7-17-19(15)14(12-23(17)4)9-18(16)22(3)11-13/h5-7,12-13,16,18,20H,8-11H2,1-4H3/t13-,16-,18-/m1/s1
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5.20n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 2C receptor


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031928
PNG
(6-Piperazin-1-yl-7,8-dihydro-benzo[k]phenanthridin...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C21H21N3/c1-2-6-16-15(5-1)9-10-18-20(16)17-7-3-4-8-19(17)23-21(18)24-13-11-22-12-14-24/h1-8,22H,9-14H2
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5.40n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031923
PNG
(6-(4-Ethyl-piperazin-1-yl)-7,8-dihydro-benzo[k]phe...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C23H25N3/c1-2-25-13-15-26(16-14-25)23-20-12-11-17-7-3-4-8-18(17)22(20)19-9-5-6-10-21(19)24-23/h3-10H,2,11-16H2,1H3
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8n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031934
PNG
(6-(4-Methyl-piperazin-1-yl)-benzo[k]phenanthridine...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21
Show InChI InChI=1S/C22H21N3/c1-24-12-14-25(15-13-24)22-19-11-10-16-6-2-3-7-17(16)21(19)18-8-4-5-9-20(18)23-22/h2-11H,12-15H2,1H3
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9.5n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031938
PNG
(6-Piperazin-1-yl-7,8-dihydro-9-oxa-5-aza-benzo[6,7...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCOc1ccccc-21
Show InChI InChI=1S/C21H21N3O/c1-3-7-18-15(5-1)20-16-6-2-4-8-19(16)25-14-9-17(20)21(23-18)24-12-10-22-11-13-24/h1-8,22H,9-14H2
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12n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031937
PNG
(7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
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12n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031936
PNG
(6-(4-Methyl-piperazin-1-yl)-7-oxa-5-aza-benzo[c]fl...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C20H19N3O/c1-22-10-12-23(13-11-22)20-19-18(14-6-2-4-8-16(14)21-20)15-7-3-5-9-17(15)24-19/h2-9H,10-13H2,1H3
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13n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031929
PNG
(6-(4-Ethyl-piperazin-1-yl)-7,8-dihydro-9-oxa-5-aza...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1CCOc1ccccc-21
Show InChI InChI=1S/C23H25N3O/c1-2-25-12-14-26(15-13-25)23-19-11-16-27-21-10-6-4-8-18(21)22(19)17-7-3-5-9-20(17)24-23/h3-10H,2,11-16H2,1H3
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14n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031940
PNG
(6-(4-Ethyl-piperazin-1-yl)-benzo[k]phenanthridine ...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21
Show InChI InChI=1S/C23H23N3/c1-2-25-13-15-26(16-14-25)23-20-12-11-17-7-3-4-8-18(17)22(20)19-9-5-6-10-21(19)24-23/h3-12H,2,13-16H2,1H3
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16n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031933
PNG
(6-Piperazin-1-yl-7-oxa-5-aza-benzo[c]fluorene | CH...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C19H17N3O/c1-3-7-15-13(5-1)17-14-6-2-4-8-16(14)23-18(17)19(21-15)22-11-9-20-10-12-22/h1-8,20H,9-12H2
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33n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031935
PNG
(8-Methoxy-6-(4-methyl-piperazin-1-yl)-benzo[k]phen...)
Show SMILES COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C23H23N3O/c1-25-11-13-26(14-12-25)23-19-15-21(27-2)16-7-3-4-8-17(16)22(19)18-9-5-6-10-20(18)24-23/h3-10,15H,11-14H2,1-2H3
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42n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50014407
PNG
(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
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43n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Effect of compound on Serotonin transporter uptake from rat cortex using [3H]citalopram as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031924
PNG
(CHEMBL304016 | [2-(7,8-Dihydro-9-oxa-5-aza-benzo[6...)
Show SMILES CN(C)CCSc1nc2ccccc2c-2c1CCOc1ccccc-21
Show InChI InChI=1S/C21H22N2OS/c1-23(2)12-14-25-21-17-11-13-24-19-10-6-4-8-16(19)20(17)15-7-3-5-9-18(15)22-21/h3-10H,11-14H2,1-2H3
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46n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031921
PNG
(6-(4-Ethyl-piperazin-1-yl)-7-oxa-5-aza-benzo[c]flu...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C21H21N3O/c1-2-23-11-13-24(14-12-23)21-20-19(15-7-3-5-9-17(15)22-21)16-8-4-6-10-18(16)25-20/h3-10H,2,11-14H2,1H3
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53n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031931
PNG
(7-(4-Ethyl-piperazin-1-yl)-6H-5-oxa-8-aza-benzo[c]...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C22H23N3O/c1-2-24-11-13-25(14-12-24)22-18-15-26-20-10-6-4-8-17(20)21(18)16-7-3-5-9-19(16)23-22/h3-10H,2,11-15H2,1H3
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53n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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66n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031941
PNG
(8-Methoxy-6-piperazin-1-yl-benzo[k]phenanthridine ...)
Show SMILES COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCNCC1
Show InChI InChI=1S/C22H21N3O/c1-26-20-14-18-21(16-7-3-2-6-15(16)20)17-8-4-5-9-19(17)24-22(18)25-12-10-23-11-13-25/h2-9,14,23H,10-13H2,1H3
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67n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031922
PNG
(6-Piperazin-1-yl-benzo[k]phenanthridine | CHEMBL61...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c1ccc1ccccc21
Show InChI InChI=1S/C21H19N3/c1-2-6-16-15(5-1)9-10-18-20(16)17-7-3-4-8-19(17)23-21(18)24-13-11-22-12-14-24/h1-10,22H,11-14H2
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130n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50014407
PNG
(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
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130n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Rattus norvegicus (Rat))
BDBM50014407
PNG
(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
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208n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 1B receptor from rat striatum using [3H]5-HT as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031926
PNG
(6-(4-Ethyl-piperazin-1-yl)-8-methoxy-benzo[k]phena...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c1cc(OC)c1ccccc21
Show InChI InChI=1S/C24H25N3O/c1-3-26-12-14-27(15-13-26)24-20-16-22(28-2)17-8-4-5-9-18(17)23(20)19-10-6-7-11-21(19)25-24/h4-11,16H,3,12-15H2,1-2H3
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220n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(GUINEA PIG)
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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230n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 4 receptor from guinea pig striatum using [3H]GR-113808 as radioligand...


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031935
PNG
(8-Methoxy-6-(4-methyl-piperazin-1-yl)-benzo[k]phen...)
Show SMILES COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCN(C)CC1
Show InChI InChI=1S/C23H23N3O/c1-25-11-13-26(14-12-25)23-19-15-21(27-2)16-7-3-4-8-17(16)22(19)18-9-5-6-10-20(18)24-23/h3-10,15H,11-14H2,1-2H3
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240n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Rattus norvegicus (Rat))
BDBM50031933
PNG
(6-Piperazin-1-yl-7-oxa-5-aza-benzo[c]fluorene | CH...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C19H17N3O/c1-3-7-15-13(5-1)17-14-6-2-4-8-16(14)23-18(17)19(21-15)22-11-9-20-10-12-22/h1-8,20H,9-12H2
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280n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 1B receptor from rat striatum using [3H]5-HT as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50031938
PNG
(6-Piperazin-1-yl-7,8-dihydro-9-oxa-5-aza-benzo[6,7...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCOc1ccccc-21
Show InChI InChI=1S/C21H21N3O/c1-3-7-18-15(5-1)20-16-6-2-4-8-19(16)25-14-9-17(20)21(23-18)24-12-10-22-11-13-24/h1-8,22H,9-14H2
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330n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Effect of compound on Serotonin transporter uptake from rat cortex using [3H]citalopram as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50031937
PNG
(7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
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360n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Effect of compound on Serotonin transporter uptake from rat cortex using [3H]citalopram as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031925
PNG
(6-(4-Methyl-piperazin-1-yl)-7,8-dihydro-benzo[k]ph...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C22H23N3/c1-24-12-14-25(15-13-24)22-19-11-10-16-6-2-3-7-17(16)21(19)18-8-4-5-9-20(18)23-22/h2-9H,10-15H2,1H3
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400n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031943
PNG
(CHEMBL64145 | Dimethyl-[2-(7-oxa-5-aza-benzo[c]flu...)
Show SMILES CN(C)CCSc1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C19H18N2OS/c1-21(2)11-12-23-19-18-17(13-7-3-5-9-15(13)20-19)14-8-4-6-10-16(14)22-18/h3-10H,11-12H2,1-2H3
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410n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Rattus norvegicus (Rat))
BDBM50031938
PNG
(6-Piperazin-1-yl-7,8-dihydro-9-oxa-5-aza-benzo[6,7...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCOc1ccccc-21
Show InChI InChI=1S/C21H21N3O/c1-3-7-18-15(5-1)20-16-6-2-4-8-19(16)25-14-9-17(20)21(23-18)24-12-10-22-11-13-24/h1-8,22H,9-14H2
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420n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
The compound was tested for their binding affinity towards 5-hydroxytryptamine 1B receptor from rat striatum using [3H]5-HT as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031936
PNG
(6-(4-Methyl-piperazin-1-yl)-7-oxa-5-aza-benzo[c]fl...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C20H19N3O/c1-22-10-12-23(13-11-22)20-19-18(14-6-2-4-8-16(14)21-20)15-7-3-5-9-17(15)24-19/h2-9H,10-13H2,1H3
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450n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031921
PNG
(6-(4-Ethyl-piperazin-1-yl)-7-oxa-5-aza-benzo[c]flu...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C21H21N3O/c1-2-23-11-13-24(14-12-23)21-20-19(15-7-3-5-9-17(15)22-21)16-8-4-6-10-18(16)25-20/h3-10H,2,11-14H2,1H3
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530n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031923
PNG
(6-(4-Ethyl-piperazin-1-yl)-7,8-dihydro-benzo[k]phe...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C23H25N3/c1-2-25-13-15-26(16-14-25)23-20-12-11-17-7-3-4-8-18(17)22(20)19-9-5-6-10-21(19)24-23/h3-10H,2,11-16H2,1H3
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600n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031940
PNG
(6-(4-Ethyl-piperazin-1-yl)-benzo[k]phenanthridine ...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21
Show InChI InChI=1S/C23H23N3/c1-2-25-13-15-26(16-14-25)23-20-12-11-17-7-3-4-8-18(17)22(20)19-9-5-6-10-21(19)24-23/h3-12H,2,13-16H2,1H3
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640n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031928
PNG
(6-Piperazin-1-yl-7,8-dihydro-benzo[k]phenanthridin...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C21H21N3/c1-2-6-16-15(5-1)9-10-18-20(16)17-7-3-4-8-19(17)23-21(18)24-13-11-22-12-14-24/h1-8,22H,9-14H2
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640n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031926
PNG
(6-(4-Ethyl-piperazin-1-yl)-8-methoxy-benzo[k]phena...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c2c1cc(OC)c1ccccc21
Show InChI InChI=1S/C24H25N3O/c1-3-26-12-14-27(15-13-26)24-20-16-22(28-2)17-8-4-5-9-18(17)23(20)19-10-6-7-11-21(19)25-24/h4-11,16H,3,12-15H2,1-2H3
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690n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031934
PNG
(6-(4-Methyl-piperazin-1-yl)-benzo[k]phenanthridine...)
Show SMILES CN1CCN(CC1)c1nc2ccccc2c2c1ccc1ccccc21
Show InChI InChI=1S/C22H21N3/c1-24-12-14-25(15-13-24)22-19-11-10-16-6-2-3-7-17(16)21(19)18-8-4-5-9-20(18)23-22/h2-11H,12-15H2,1H3
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920n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031944
PNG
(CHEMBL64079 | [2-(7,8-Dihydro-benzo[k]phenanthridi...)
Show SMILES CN(C)CCSc1nc2ccccc2c-2c1CCc1ccccc-21
Show InChI InChI=1S/C21H22N2S/c1-23(2)13-14-24-21-18-12-11-15-7-3-4-8-16(15)20(18)17-9-5-6-10-19(17)22-21/h3-10H,11-14H2,1-2H3
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930n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031931
PNG
(7-(4-Ethyl-piperazin-1-yl)-6H-5-oxa-8-aza-benzo[c]...)
Show SMILES CCN1CCN(CC1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C22H23N3O/c1-2-24-11-13-25(14-12-24)22-18-15-26-20-10-6-4-8-17(20)21(18)16-7-3-5-9-19(16)23-22/h3-10H,2,11-15H2,1H3
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1.10E+3n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031922
PNG
(6-Piperazin-1-yl-benzo[k]phenanthridine | CHEMBL61...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c1ccc1ccccc21
Show InChI InChI=1S/C21H19N3/c1-2-6-16-15(5-1)9-10-18-20(16)17-7-3-4-8-19(17)23-21(18)24-13-11-22-12-14-24/h1-10,22H,11-14H2
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1.10E+3n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031941
PNG
(8-Methoxy-6-piperazin-1-yl-benzo[k]phenanthridine ...)
Show SMILES COc1cc2c(nc3ccccc3c2c2ccccc12)N1CCNCC1
Show InChI InChI=1S/C22H21N3O/c1-26-20-14-18-21(16-7-3-2-6-15(16)20)17-8-4-5-9-19(17)24-22(18)25-12-10-23-11-13-25/h2-9,14,23H,10-13H2,1H3
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1.10E+3n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031933
PNG
(6-Piperazin-1-yl-7-oxa-5-aza-benzo[c]fluorene | CH...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C19H17N3O/c1-3-7-15-13(5-1)17-14-6-2-4-8-16(14)23-18(17)19(21-15)22-11-9-20-10-12-22/h1-8,20H,9-12H2
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1.20E+3n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
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