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9 similar compounds to monomer 50406149

Compile data set for download or QSAR
Wt: 291.3
BDBM50019751
Wt: 291.3
BDBM50019753
Wt: 391.4
BDBM50133931
Wt: 261.7
BDBM50406154
Wt: 272.3
BDBM50406161
Wt: 374.4
BDBM50406165
Wt: 257.3
BDBM50406167
Wt: 241.3
BDBM50406141
Wt: 242.3
BDBM50406150

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50019751,50019753,50133931,50406154,50406161,50406165,50406167,50406141,50406150   
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
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50133931
PNG
(1-(4-fluoro-phenyl)-4-(3,4,6,7,12,12a-hexahydro-1H...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCN2Cc3[nH]c4ccccc4c3CC2C1
Show InChI InChI=1S/C24H26FN3O/c25-18-9-7-17(8-10-18)24(29)6-3-11-27-12-13-28-16-23-21(14-19(28)15-27)20-4-1-2-5-22(20)26-23/h1-2,4-5,7-10,19,26H,3,6,11-16H2
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11n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Ability to compete with [3H]YM-09151-2 binding to the human dopamine receptor D3 transfected in CHO cells


J Med Chem 46: 4377-92 (2003)


Article DOI: 10.1021/jm030085p
BindingDB Entry DOI: 10.7270/Q21V5FPS
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50019753
PNG
(2-(3-Pyridin-4-yl-propyl)-2,3,4,9-tetrahydro-1H-be...)
Show SMILES C(CN1CCc2c(C1)[nH]c1ccccc21)Cc1ccncc1
Show InChI InChI=1S/C19H21N3/c1-2-6-18-16(5-1)17-9-13-22(14-19(17)21-18)12-3-4-15-7-10-20-11-8-15/h1-2,5-8,10-11,21H,3-4,9,12-14H2
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1.12E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity for dopamine receptor D2 of rat nucleus accumbens labeled with [3H]-spiperone


J Med Chem 30: 1100-5 (1987)


Article DOI: 10.1021/jm00389a022
BindingDB Entry DOI: 10.7270/Q2K35SNV
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50019751
PNG
(2-(3-Pyridin-3-yl-propyl)-2,3,4,9-tetrahydro-1H-be...)
Show SMILES C(CN1CCc2c(C1)[nH]c1ccccc21)Cc1cccnc1
Show InChI InChI=1S/C19H21N3/c1-2-8-18-16(7-1)17-9-12-22(14-19(17)21-18)11-4-6-15-5-3-10-20-13-15/h1-3,5,7-8,10,13,21H,4,6,9,11-12,14H2
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2.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity for dopamine receptor D2 of rat nucleus accumbens labeled with [3H]-spiperone


J Med Chem 30: 1100-5 (1987)


Article DOI: 10.1021/jm00389a022
BindingDB Entry DOI: 10.7270/Q2K35SNV
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406161
PNG
(CHEMBL97938)
Show SMILES [O-][N+](=O)N1CCN2Cc3[nH]c4ccccc4c3CC2C1
Show InChI InChI=1S/C14H16N4O2/c19-18(20)17-6-5-16-9-14-12(7-10(16)8-17)11-3-1-2-4-13(11)15-14/h1-4,10,15H,5-9H2
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n/an/a 375n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406165
PNG
(CHEMBL100865)
Show SMILES O=C(CCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)Nc1ccccc1
Show InChI InChI=1S/C23H26N4O/c28-23(24-17-6-2-1-3-7-17)10-11-26-12-13-27-16-22-20(14-18(27)15-26)19-8-4-5-9-21(19)25-22/h1-9,18,25H,10-16H2,(H,24,28)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406154
PNG
(CHEMBL100442)
Show SMILES ClN1CCN2Cc3[nH]c4ccccc4c3CC2C1
Show InChI InChI=1S/C14H16ClN3/c15-18-6-5-17-9-14-12(7-10(17)8-18)11-3-1-2-4-13(11)16-14/h1-4,10,16H,5-9H2
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n/an/a 206n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406167
PNG
(CHEMBL101490)
Show SMILES CON1CCN2Cc3[nH]c4ccccc4c3CC2C1
Show InChI InChI=1S/C15H19N3O/c1-19-18-7-6-17-10-15-13(8-11(17)9-18)12-4-2-3-5-14(12)16-15/h2-5,11,16H,6-10H2,1H3
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n/an/a 364n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406141
PNG
(CHEMBL321104)
Show SMILES CN1CCN2Cc3[nH]c4ccccc4c3CC2C1
Show InChI InChI=1S/C15H19N3/c1-17-6-7-18-10-15-13(8-11(18)9-17)12-4-2-3-5-14(12)16-15/h2-5,11,16H,6-10H2,1H3
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n/an/a 283n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406150
PNG
(CHEMBL327724)
Show SMILES NN1CCN2Cc3[nH]c4ccccc4c3CC2C1
Show InChI InChI=1S/C14H18N4/c15-18-6-5-17-9-14-12(7-10(17)8-18)11-3-1-2-4-13(11)16-14/h1-4,10,16H,5-9,15H2
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n/an/a 925n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair