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PubMed code 1469699

Compile data set for download or QSAR
Found 12 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
Glutamate-NMDA


(RAT)
BDBM83449
PNG
(1-(1-phenylcyclohexyl)piperidine;hydrochloride | M...)
Show SMILES C1CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2
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PubMed
65n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-TCP from PCP N-methyl-D-aspartate glutamate receptor in rat brain


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50004109
PNG
(1-(2-Phenyl-bicyclo[3.1.0]hex-2-yl)-piperidine | C...)
Show SMILES C1[C@@H]2CC[C@@]([C@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-15(8-4-1)17(10-9-14-13-16(14)17)18-11-5-2-6-12-18/h1,3-4,7-8,14,16H,2,5-6,9-13H2/t14-,16+,17+/m0/s1
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582n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-TCP from PCP N-methyl-D-aspartate glutamate receptor in rat brain


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50004111
PNG
(1-(3-Phenyl-bicyclo[3.1.0]hex-3-yl)-piperidine | C...)
Show SMILES C1[C@H]2C[C@](C[C@@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-16(8-4-1)17(12-14-11-15(14)13-17)18-9-5-2-6-10-18/h1,3-4,7-8,14-15H,2,5-6,9-13H2/t14-,15+,17+
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644n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-TCP from PCP N-methyl-D-aspartate glutamate receptor in rat brain


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50004113
PNG
(1-(3-Phenyl-bicyclo[3.1.0]hex-3-yl)-piperidine | C...)
Show SMILES C1[C@H]2C[C@@](C[C@@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-16(8-4-1)17(12-14-11-15(14)13-17)18-9-5-2-6-10-18/h1,3-4,7-8,14-15H,2,5-6,9-13H2/t14-,15+,17-
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711n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-TCP from PCP N-methyl-D-aspartate glutamate receptor in rat brain


Citation and Details
More data for this
Ligand-Target Pair
Sigma


(HUMAN)
BDBM83449
PNG
(1-(1-phenylcyclohexyl)piperidine;hydrochloride | M...)
Show SMILES C1CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2
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1.09E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-(+)-pentazocine from sigma receptor in Guinea pig brain


Citation and Details
More data for this
Ligand-Target Pair
Sigma


(HUMAN)
BDBM50004112
PNG
(1-(2-Phenyl-bicyclo[3.1.0]hex-2-yl)-piperidine | C...)
Show SMILES C1[C@@H]2CC[C@]([C@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-15(8-4-1)17(10-9-14-13-16(14)17)18-11-5-2-6-12-18/h1,3-4,7-8,14,16H,2,5-6,9-13H2/t14-,16+,17-/m0/s1
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1.13E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-(+)-pentazocine from sigma receptor in Guinea pig brain


Citation and Details
More data for this
Ligand-Target Pair
Sigma


(HUMAN)
BDBM50004113
PNG
(1-(3-Phenyl-bicyclo[3.1.0]hex-3-yl)-piperidine | C...)
Show SMILES C1[C@H]2C[C@@](C[C@@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-16(8-4-1)17(12-14-11-15(14)13-17)18-9-5-2-6-10-18/h1,3-4,7-8,14-15H,2,5-6,9-13H2/t14-,15+,17-
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3.72E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-(+)-pentazocine from sigma receptor in Guinea pig brain


Citation and Details
More data for this
Ligand-Target Pair
Sigma


(HUMAN)
BDBM50004109
PNG
(1-(2-Phenyl-bicyclo[3.1.0]hex-2-yl)-piperidine | C...)
Show SMILES C1[C@@H]2CC[C@@]([C@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-15(8-4-1)17(10-9-14-13-16(14)17)18-11-5-2-6-12-18/h1,3-4,7-8,14,16H,2,5-6,9-13H2/t14-,16+,17+/m0/s1
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4.45E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-(+)-pentazocine from sigma receptor in Guinea pig brain


Citation and Details
More data for this
Ligand-Target Pair
Sigma


(HUMAN)
BDBM50004110
PNG
(1-(2-Phenyl-bicyclo[3.1.0]hex-2-yl)-piperidine | C...)
Show SMILES C1[C@H]2CC[C@@]([C@@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-15(8-4-1)17(10-9-14-13-16(14)17)18-11-5-2-6-12-18/h1,3-4,7-8,14,16H,2,5-6,9-13H2/t14-,16+,17-/m1/s1
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7.28E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-(+)-pentazocine from sigma receptor in Guinea pig brain


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50004112
PNG
(1-(2-Phenyl-bicyclo[3.1.0]hex-2-yl)-piperidine | C...)
Show SMILES C1[C@@H]2CC[C@]([C@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-15(8-4-1)17(10-9-14-13-16(14)17)18-11-5-2-6-12-18/h1,3-4,7-8,14,16H,2,5-6,9-13H2/t14-,16+,17-/m0/s1
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8.22E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-TCP from PCP N-methyl-D-aspartate glutamate receptor in rat brain


Citation and Details
More data for this
Ligand-Target Pair
Sigma


(HUMAN)
BDBM50004111
PNG
(1-(3-Phenyl-bicyclo[3.1.0]hex-3-yl)-piperidine | C...)
Show SMILES C1[C@H]2C[C@](C[C@@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-16(8-4-1)17(12-14-11-15(14)13-17)18-9-5-2-6-10-18/h1,3-4,7-8,14-15H,2,5-6,9-13H2/t14-,15+,17+
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1.63E+4n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-(+)-pentazocine from sigma receptor in Guinea pig brain


Citation and Details
More data for this
Ligand-Target Pair
Glutamate-NMDA


(RAT)
BDBM50004110
PNG
(1-(2-Phenyl-bicyclo[3.1.0]hex-2-yl)-piperidine | C...)
Show SMILES C1[C@H]2CC[C@@]([C@@H]12)(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H23N/c1-3-7-15(8-4-1)17(10-9-14-13-16(14)17)18-11-5-2-6-12-18/h1,3-4,7-8,14,16H,2,5-6,9-13H2/t14-,16+,17-/m1/s1
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2.90E+4n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Compound was evaluated for its ability to displace [3H]-TCP from PCP N-methyl-D-aspartate glutamate receptor in rat brain


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%