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Compile Data Set for Download or QSAR

Found 16 hits with Last Name = 'findell' and Initial = 'pr'   
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
D(2) dopamine receptor


(BOVINE)
BDBM50017466
PNG
(2-Methylsulfanylmethyl-4-propyl-1,2,3,4,4a,5,6,10b...)
Show SMILES CCCN1C[C@H](CSC)C[C@H]2[C@H]1CCc1cc(O)c(O)cc21
Show InChI InChI=1S/C18H27NO2S/c1-3-6-19-10-12(11-22-2)7-15-14-9-18(21)17(20)8-13(14)4-5-16(15)19/h8-9,12,15-16,20-21H,3-7,10-11H2,1-2H3/t12-,15-,16-/m1/s1
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2n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
High binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017469
PNG
((9-Hydroxy-4-propyl-1,2,3,4,4a,5,6,10b-octahydro-b...)
Show SMILES CCCN1C[C@H](CC#N)C[C@H]2[C@H]1CCc1ccc(O)cc21
Show InChI InChI=1S/C18H24N2O/c1-2-9-20-12-13(7-8-19)10-17-16-11-15(21)5-3-14(16)4-6-18(17)20/h3,5,11,13,17-18,21H,2,4,6-7,9-10,12H2,1H3/t13-,17-,18-/m1/s1
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4n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017464
PNG
((8,9-Dihydroxy-4-propyl-1,2,3,4,4a,5,6,10b-octahyd...)
Show SMILES CCCN1C[C@H](CC#N)C[C@H]2[C@H]1CCc1cc(O)c(O)cc21
Show InChI InChI=1S/C18H24N2O2/c1-2-7-20-11-12(5-6-19)8-15-14-10-18(22)17(21)9-13(14)3-4-16(15)20/h9-10,12,15-16,21-22H,2-5,7-8,11H2,1H3/t12-,15-,16-/m1/s1
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6n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017462
PNG
(2-Methyl-4-propyl-1,2,3,4,4a,5,6,10b-octahydro-ben...)
Show SMILES CCCN1C[C@H](C)C[C@H]2[C@H]1CCc1ccc(O)cc21
Show InChI InChI=1S/C17H25NO/c1-3-8-18-11-12(2)9-16-15-10-14(19)6-4-13(15)5-7-17(16)18/h4,6,10,12,16-17,19H,3,5,7-9,11H2,1-2H3/t12-,16-,17-/m1/s1
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8n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
High binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017461
PNG
(2-Methylsulfanylmethyl-4-propyl-1,2,3,4,4a,5,6,10b...)
Show SMILES CCCN1C[C@H](CSC)C[C@H]2[C@H]1CCc1ccc(O)cc21
Show InChI InChI=1S/C18H27NOS/c1-3-8-19-11-13(12-21-2)9-17-16-10-15(20)6-4-14(16)5-7-18(17)19/h4,6,10,13,17-18,20H,3,5,7-9,11-12H2,1-2H3/t13-,17-,18-/m1/s1
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14n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
High binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol in bovine...


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM55121
PNG
(3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...)
Show SMILES NCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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34n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
High binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017466
PNG
(2-Methylsulfanylmethyl-4-propyl-1,2,3,4,4a,5,6,10b...)
Show SMILES CCCN1C[C@H](CSC)C[C@H]2[C@H]1CCc1cc(O)c(O)cc21
Show InChI InChI=1S/C18H27NO2S/c1-3-6-19-10-12(11-22-2)7-15-14-9-18(21)17(20)8-13(14)4-5-16(15)19/h8-9,12,15-16,20-21H,3-7,10-11H2,1-2H3/t12-,15-,16-/m1/s1
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110n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
High binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017467
PNG
(2-Methylsulfanylmethyl-4-propyl-1,2,3,4,4a,5,6,10b...)
Show SMILES CCCN1C[C@H](CSC)C[C@H]2[C@H]1CCc1c(O)cccc21
Show InChI InChI=1S/C18H27NOS/c1-3-9-19-11-13(12-21-2)10-16-14-5-4-6-18(20)15(14)7-8-17(16)19/h4-6,13,16-17,20H,3,7-12H2,1-2H3/t13-,16-,17-/m1/s1
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250n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine receptor D2 from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol in bovine a...


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017469
PNG
((9-Hydroxy-4-propyl-1,2,3,4,4a,5,6,10b-octahydro-b...)
Show SMILES CCCN1C[C@H](CC#N)C[C@H]2[C@H]1CCc1ccc(O)cc21
Show InChI InChI=1S/C18H24N2O/c1-2-9-20-12-13(7-8-19)10-17-16-11-15(21)5-3-14(16)4-6-18(17)20/h3,5,11,13,17-18,21H,2,4,6-7,9-10,12H2,1H3/t13-,17-,18-/m1/s1
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280n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol in bovine ...


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017464
PNG
((8,9-Dihydroxy-4-propyl-1,2,3,4,4a,5,6,10b-octahyd...)
Show SMILES CCCN1C[C@H](CC#N)C[C@H]2[C@H]1CCc1cc(O)c(O)cc21
Show InChI InChI=1S/C18H24N2O2/c1-2-7-20-11-12(5-6-19)8-15-14-10-18(22)17(21)9-13(14)3-4-16(15)20/h9-10,12,15-16,21-22H,2-5,7-8,11H2,1H3/t12-,15-,16-/m1/s1
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360n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017461
PNG
(2-Methylsulfanylmethyl-4-propyl-1,2,3,4,4a,5,6,10b...)
Show SMILES CCCN1C[C@H](CSC)C[C@H]2[C@H]1CCc1ccc(O)cc21
Show InChI InChI=1S/C18H27NOS/c1-3-8-19-11-13(12-21-2)9-17-16-10-15(20)6-4-14(16)5-7-18(17)19/h4,6,10,13,17-18,20H,3,5,7-9,11-12H2,1-2H3/t13-,17-,18-/m1/s1
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1.21E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol in bovinea...


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017463
PNG
((7,8-Dihydroxy-4-propyl-1,2,3,4,4a,5,6,10b-octahyd...)
Show SMILES CCCN1C[C@H](CC#N)C[C@H]2[C@H]1CCc1c(O)c(O)ccc21
Show InChI InChI=1S/C18H24N2O2/c1-2-9-20-11-12(7-8-19)10-15-13-4-6-17(21)18(22)14(13)3-5-16(15)20/h4,6,12,15-16,21-22H,2-3,5,7,9-11H2,1H3/t12-,15-,16-/m1/s1
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1.46E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017468
PNG
(2-Methylsulfanylmethyl-4-propyl-1,2,3,4,4a,5,6,10b...)
Show SMILES CCCN1C[C@H](CSC)C[C@H]2[C@H]1CCc1c(O)c(O)ccc21
Show InChI InChI=1S/C18H27NO2S/c1-3-8-19-10-12(11-22-2)9-15-13-5-7-17(20)18(21)14(13)4-6-16(15)19/h5,7,12,15-16,20-21H,3-4,6,8-11H2,1-2H3/t12-,15-,16-/m1/s1
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1.73E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017462
PNG
(2-Methyl-4-propyl-1,2,3,4,4a,5,6,10b-octahydro-ben...)
Show SMILES CCCN1C[C@H](C)C[C@H]2[C@H]1CCc1ccc(O)cc21
Show InChI InChI=1S/C17H25NO/c1-3-8-18-11-12(2)9-16-15-10-14(19)6-4-13(15)5-7-17(16)18/h4,6,10,12,16-17,19H,3,5,7-9,11H2,1-2H3/t12-,16-,17-/m1/s1
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1.94E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
High binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol in bovine...


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM55121
PNG
(3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...)
Show SMILES NCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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3.38E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(BOVINE)
BDBM50017465
PNG
((7-Hydroxy-4-propyl-1,2,3,4,4a,5,6,10b-octahydro-b...)
Show SMILES CCCN1C[C@H](CC#N)C[C@H]2[C@H]1CCc1c(O)cccc21
Show InChI InChI=1S/C18H24N2O/c1-2-10-20-12-13(8-9-19)11-16-14-4-3-5-18(21)15(14)6-7-17(16)20/h3-5,13,16-17,21H,2,6-8,10-12H2,1H3/t13-,16-,17-/m1/s1
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5.39E+3n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Low binding affinity of the compound for dopamine D-2 receptor from bovine anterior pitutary membrane, using radioligand [3H]-spiroperidol in bovine ...


J Med Chem 32: 961-8 (1989)


BindingDB Entry DOI: 10.7270/Q2CN72WQ
More data for this
Ligand-Target Pair