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PubMed code 1354263

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
Serotonin 1 (5-HT1) receptor


(RAT-Rattus norvegicus (rat)-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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Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte carbonic anhydrase II


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Serotonin 1 (5-HT1) receptor


(RAT-Rattus norvegicus (rat)-Rattus norvegicus (Rat...)
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte carbonic anhydrase II


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50010617
PNG
((-)-3-(1-Propyl-piperidin-3-yl)-phenol | (S)-3-(1-...)
Show SMILES CCCN1CCC[C@H](C1)c1cccc(O)c1
Show InChI InChI=1S/C14H21NO/c1-2-8-15-9-4-6-13(11-15)12-5-3-7-14(16)10-12/h3,5,7,10,13,16H,2,4,6,8-9,11H2,1H3/t13-/m1/s1
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n/an/a 700n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Ability to displace [3H]spiroperidol, from dopamine receptor D2 specific binding sites of rat striatal membranes


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Serotonin 1 (5-HT1) receptor


(RAT-Rattus norvegicus (rat)-Rattus norvegicus (Rat...)
BDBM50229868
PNG
(CHEMBL102288)
Show SMILES CCCN1CCOC(C1)c1ccccc1OC
Show InChI InChI=1S/C14H21NO2/c1-3-8-15-9-10-17-14(11-15)12-6-4-5-7-13(12)16-2/h4-7,14H,3,8-11H2,1-2H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte carbonic anhydrase II


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Serotonin 1 (5-HT1) receptor


(RAT-Rattus norvegicus (rat)-Rattus norvegicus (Rat...)
BDBM50002127
PNG
(2-(3-Methoxy-phenyl)-4-propyl-morpholine | 2-(3-me...)
Show SMILES CCCN1CCOC(C1)c1cccc(OC)c1
Show InChI InChI=1S/C14H21NO2/c1-3-7-15-8-9-17-14(11-15)12-5-4-6-13(10-12)16-2/h4-6,10,14H,3,7-9,11H2,1-2H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte carbonic anhydrase II


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Serotonin 1 (5-HT1) receptor


(RAT-Rattus norvegicus (rat)-Rattus norvegicus (Rat...)
BDBM50229869
PNG
(CHEMBL432595)
Show SMILES CCCN1CCOC(C1)c1ccccc1Cl
Show InChI InChI=1S/C13H18ClNO/c1-2-7-15-8-9-16-13(10-15)11-5-3-4-6-12(11)14/h3-6,13H,2,7-10H2,1H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte carbonic anhydrase II


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Serotonin 1 (5-HT1) receptor


(RAT-Rattus norvegicus (rat)-Rattus norvegicus (Rat...)
BDBM50002129
PNG
(2-(3-Chloro-phenyl)-4-propyl-morpholine | 2-(3-chl...)
Show SMILES CCCN1CCOC(C1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H18ClNO/c1-2-6-15-7-8-16-13(10-15)11-4-3-5-12(14)9-11/h3-5,9,13H,2,6-8,10H2,1H3
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PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte carbonic anhydrase II


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50002126
PNG
(2-(1-Propyl-piperidin-3-yl)-phenol | CHEMBL104987)
Show SMILES CCCN1CCCC(C1)c1ccccc1O
Show InChI InChI=1S/C14H21NO/c1-2-9-15-10-5-6-12(11-15)13-7-3-4-8-14(13)16/h3-4,7-8,12,16H,2,5-6,9-11H2,1H3
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n/an/a 7.00E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Ability to displace [3H]spiroperidol, from dopamine receptor D2 specific binding sites of rat striatal membranes


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50002130
PNG
(3-(2-Methoxy-phenyl)-1-propyl-piperidine | 3-(2-Me...)
Show SMILES CCCN1CCCC(C1)c1ccccc1OC
Show InChI InChI=1S/C15H23NO/c1-3-10-16-11-6-7-13(12-16)14-8-4-5-9-15(14)17-2/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3
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PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



Universit£ di Bari

Curated by ChEMBL


Assay Description
Ability to displace [3H]spiroperidol, from dopamine receptor D2 specific binding sites of rat striatal membranes


J Med Chem 35: 3045-9 (1992)


Article DOI: 10.1021/jm00094a019
BindingDB Entry DOI: 10.7270/Q2JD4XDS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%