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5 similar compounds to monomer 50083342

Wt: 357.8
BDBM50083343
Wt: 323.3
BDBM50083344
Wt: 353.4
BDBM50083345
Wt: 337.4
BDBM50083347
Wt: 351.4
BDBM50083348

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50083343,50083344,50083345,50083347,50083348   
Target
(Institution)
LigandTarget
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
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50083345
PNG
(7-[4-(4-Methoxy-phenyl)-piperazin-1-ylmethyl]-4H-b...)
Show SMILES COc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C20H23N3O3/c1-25-17-5-3-16(4-6-17)23-10-8-22(9-11-23)13-15-2-7-18-19(12-15)26-14-20(24)21-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
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5n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50083344
PNG
(7-(4-Phenyl-piperazin-1-ylmethyl)-4H-benzo[1,4]oxa...)
Show SMILES O=C1COc2cc(CN3CCN(CC3)c3ccccc3)ccc2N1
Show InChI InChI=1S/C19H21N3O2/c23-19-14-24-18-12-15(6-7-17(18)20-19)13-21-8-10-22(11-9-21)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2,(H,20,23)
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6.10n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50083348
PNG
(7-[4-(3,4-Dimethyl-phenyl)-piperazin-1-ylmethyl]-4...)
Show SMILES Cc1ccc(cc1C)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C21H25N3O2/c1-15-3-5-18(11-16(15)2)24-9-7-23(8-10-24)13-17-4-6-19-20(12-17)26-14-21(25)22-19/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,22,25)
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6.90n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptors; D3 & D4


(Homo sapiens (Human))
BDBM50083344
PNG
(7-(4-Phenyl-piperazin-1-ylmethyl)-4H-benzo[1,4]oxa...)
Show SMILES O=C1COc2cc(CN3CCN(CC3)c3ccccc3)ccc2N1
Show InChI InChI=1S/C19H21N3O2/c23-19-14-24-18-12-15(6-7-17(18)20-19)13-21-8-10-22(11-9-21)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2,(H,20,23)
PDB

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10n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50083347
PNG
(7-(4-p-Tolyl-piperazin-1-ylmethyl)-4H-benzo[1,4]ox...)
Show SMILES Cc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C20H23N3O2/c1-15-2-5-17(6-3-15)23-10-8-22(9-11-23)13-16-4-7-18-19(12-16)25-14-20(24)21-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
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11n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50083343
PNG
(6-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-4H-be...)
Show SMILES Clc1ccc(cc1)N1CCN(Cc2ccc3OCC(=O)Nc3c2)CC1
Show InChI InChI=1S/C19H20ClN3O2/c20-15-2-4-16(5-3-15)23-9-7-22(8-10-23)12-14-1-6-18-17(11-14)21-19(24)13-25-18/h1-6,11H,7-10,12-13H2,(H,21,24)
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62n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptors; D3 & D4


(Homo sapiens (Human))
BDBM50083348
PNG
(7-[4-(3,4-Dimethyl-phenyl)-piperazin-1-ylmethyl]-4...)
Show SMILES Cc1ccc(cc1C)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C21H25N3O2/c1-15-3-5-18(11-16(15)2)24-9-7-23(8-10-24)13-17-4-6-19-20(12-17)26-14-21(25)22-19/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,22,25)
PDB

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79n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM50083344
PNG
(7-(4-Phenyl-piperazin-1-ylmethyl)-4H-benzo[1,4]oxa...)
Show SMILES O=C1COc2cc(CN3CCN(CC3)c3ccccc3)ccc2N1
Show InChI InChI=1S/C19H21N3O2/c23-19-14-24-18-12-15(6-7-17(18)20-19)13-21-8-10-22(11-9-21)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2,(H,20,23)
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129n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptors; D3 & D4


(Homo sapiens (Human))
BDBM50083347
PNG
(7-(4-p-Tolyl-piperazin-1-ylmethyl)-4H-benzo[1,4]ox...)
Show SMILES Cc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C20H23N3O2/c1-15-2-5-17(6-3-15)23-10-8-22(9-11-23)13-16-4-7-18-19(12-16)25-14-20(24)21-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
PDB

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208n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM50083348
PNG
(7-[4-(3,4-Dimethyl-phenyl)-piperazin-1-ylmethyl]-4...)
Show SMILES Cc1ccc(cc1C)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C21H25N3O2/c1-15-3-5-18(11-16(15)2)24-9-7-23(8-10-24)13-17-4-6-19-20(12-17)26-14-21(25)22-19/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,22,25)
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346n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptors; D3 & D4


(Homo sapiens (Human))
BDBM50083345
PNG
(7-[4-(4-Methoxy-phenyl)-piperazin-1-ylmethyl]-4H-b...)
Show SMILES COc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C20H23N3O3/c1-25-17-5-3-16(4-6-17)23-10-8-22(9-11-23)13-15-2-7-18-19(12-15)26-14-20(24)21-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
PDB

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PubMed
1.79E+3n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM50083347
PNG
(7-(4-p-Tolyl-piperazin-1-ylmethyl)-4H-benzo[1,4]ox...)
Show SMILES Cc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C20H23N3O2/c1-15-2-5-17(6-3-15)23-10-8-22(9-11-23)13-16-4-7-18-19(12-16)25-14-20(24)21-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
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2.98E+3n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptors; D3 & D4


(Homo sapiens (Human))
BDBM50083343
PNG
(6-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-4H-be...)
Show SMILES Clc1ccc(cc1)N1CCN(Cc2ccc3OCC(=O)Nc3c2)CC1
Show InChI InChI=1S/C19H20ClN3O2/c20-15-2-4-16(5-3-15)23-9-7-22(8-10-23)12-14-1-6-18-17(11-14)21-19(24)13-25-18/h1-6,11H,7-10,12-13H2,(H,21,24)
PDB

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>3.03E+3n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM50083345
PNG
(7-[4-(4-Methoxy-phenyl)-piperazin-1-ylmethyl]-4H-b...)
Show SMILES COc1ccc(cc1)N1CCN(Cc2ccc3NC(=O)COc3c2)CC1
Show InChI InChI=1S/C20H23N3O3/c1-25-17-5-3-16(4-6-17)23-10-8-22(9-11-23)13-15-2-7-18-19(12-15)26-14-20(24)21-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
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>5.88E+3n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM50083343
PNG
(6-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-4H-be...)
Show SMILES Clc1ccc(cc1)N1CCN(Cc2ccc3OCC(=O)Nc3c2)CC1
Show InChI InChI=1S/C19H20ClN3O2/c20-15-2-4-16(5-3-15)23-9-7-22(8-10-23)12-14-1-6-18-17(11-14)21-19(24)13-25-18/h1-6,11H,7-10,12-13H2,(H,21,24)
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>5.88E+3n/an/an/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.


J Med Chem 42: 5181-7 (2000)

More data for this
Ligand-Target Pair