BindingDB logo
myBDB logout

PubMed code 16762550

Compile data set for download or QSAR
Found 101 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
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188855
PNG
(1-phenyl-8-(1-phenyl-cyclohexyl)-1,3,8-triaza-spir...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C25H31N3O/c29-23-25(28(20-26-23)22-12-6-2-7-13-22)16-18-27(19-17-25)24(14-8-3-9-15-24)21-10-4-1-5-11-21/h1-2,4-7,10-13H,3,8-9,14-20H2,(H,26,29)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188855
PNG
(1-phenyl-8-(1-phenyl-cyclohexyl)-1,3,8-triaza-spir...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C25H31N3O/c29-23-25(28(20-26-23)22-12-6-2-7-13-22)16-18-27(19-17-25)24(14-8-3-9-15-24)21-10-4-1-5-11-21/h1-2,4-7,10-13H,3,8-9,14-20H2,(H,26,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of hERG potassium channel expressed in CHO cells by whole cell patch clamp method


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188843
PNG
(8-(1-phenyl-cyclohexyl)-4-propyl-2,8-diaza-spiro[4...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C23H34N2O/c1-2-9-20-18-24-21(26)22(20)14-16-25(17-15-22)23(12-7-4-8-13-23)19-10-5-3-6-11-19/h3,5-6,10-11,20H,2,4,7-9,12-18H2,1H3,(H,24,26)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.87E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188843
PNG
(8-(1-phenyl-cyclohexyl)-4-propyl-2,8-diaza-spiro[4...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C23H34N2O/c1-2-9-20-18-24-21(26)22(20)14-16-25(17-15-22)23(12-7-4-8-13-23)19-10-5-3-6-11-19/h3,5-6,10-11,20H,2,4,7-9,12-18H2,1H3,(H,24,26)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.87E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188843
PNG
(8-(1-phenyl-cyclohexyl)-4-propyl-2,8-diaza-spiro[4...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C23H34N2O/c1-2-9-20-18-24-21(26)22(20)14-16-25(17-15-22)23(12-7-4-8-13-23)19-10-5-3-6-11-19/h3,5-6,10-11,20H,2,4,7-9,12-18H2,1H3,(H,24,26)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.73E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188879
PNG
(CHEMBL214057 | rac-8-[1-(4-fluoro-phenyl)-cyclohex...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C23H33FN2O/c1-2-6-19-17-25-21(27)22(19)13-15-26(16-14-22)23(11-4-3-5-12-23)18-7-9-20(24)10-8-18/h7-10,19H,2-6,11-17H2,1H3,(H,25,27)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.03E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188859
PNG
(CHEMBL378665 | rac-4-(4-fluoro-phenyl)-8-(1-o-toly...)
Show SMILES Cc1ccccc1C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-7-3-4-8-23(20)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-9-11-22(28)12-10-21/h3-4,7-12,24H,2,5-6,13-19H2,1H3,(H,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.85E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.50E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.50E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.15E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.15E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188863
PNG
(CHEMBL436752 | rac-4-(4-fluoro-phenyl)-8-[1-(3-flu...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(F)c1
Show InChI InChI=1S/C26H30F2N2O/c27-21-9-7-19(8-10-21)23-18-29-24(31)25(23)13-15-30(16-14-25)26(11-2-1-3-12-26)20-5-4-6-22(28)17-20/h4-10,17,23H,1-3,11-16,18H2,(H,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.18E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.80E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.04E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.04E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.12E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.12E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188859
PNG
(CHEMBL378665 | rac-4-(4-fluoro-phenyl)-8-(1-o-toly...)
Show SMILES Cc1ccccc1C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-7-3-4-8-23(20)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-9-11-22(28)12-10-21/h3-4,7-12,24H,2,5-6,13-19H2,1H3,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188863
PNG
(CHEMBL436752 | rac-4-(4-fluoro-phenyl)-8-[1-(3-flu...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(F)c1
Show InChI InChI=1S/C26H30F2N2O/c27-21-9-7-19(8-10-21)23-18-29-24(31)25(23)13-15-30(16-14-25)26(11-2-1-3-12-26)20-5-4-6-22(28)17-20/h4-10,17,23H,1-3,11-16,18H2,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (human))
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50188867
PNG
(4-phenyl-8-(3-phenyl-tetrahydro-pyran-3-yl)-2,8-di...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCOC1)c1ccccc1
Show InChI InChI=1S/C25H30N2O2/c28-23-24(22(18-26-23)20-8-3-1-4-9-20)13-15-27(16-14-24)25(12-7-17-29-19-25)21-10-5-2-6-11-21/h1-6,8-11,22H,7,12-19H2,(H,26,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.10E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of hERG potassium channel expressed in CHO cells by whole cell patch clamp method


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50188870
PNG
(4-phenyl-8-(4-phenyl-tetrahydro-pyran-4-yl)-2,8-di...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCOCC1)c1ccccc1
Show InChI InChI=1S/C25H30N2O2/c28-23-24(22(19-26-23)20-7-3-1-4-8-20)11-15-27(16-12-24)25(13-17-29-18-14-25)21-9-5-2-6-10-21/h1-10,22H,11-19H2,(H,26,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.40E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of hERG potassium channel expressed in CHO cells by whole cell patch clamp method


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.98E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.98E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.48E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.48E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]naloxone from mu opioid receptor expressed in BHK cells


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 810n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188852
PNG
(CHEMBL211734 | rac-3-{1-[4-(4-fluoro-phenyl)-1-oxo...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(c1)C#N
Show InChI InChI=1S/C27H30FN3O/c28-23-9-7-21(8-10-23)24-19-30-25(32)26(24)13-15-31(16-14-26)27(11-2-1-3-12-27)22-6-4-5-20(17-22)18-29/h4-10,17,24H,1-3,11-16,19H2,(H,30,32)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 77n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188855
PNG
(1-phenyl-8-(1-phenyl-cyclohexyl)-1,3,8-triaza-spir...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C25H31N3O/c29-23-25(28(20-26-23)22-12-6-2-7-13-22)16-18-27(19-17-25)24(14-8-3-9-15-24)21-10-4-1-5-11-21/h1-2,4-7,10-13H,3,8-9,14-20H2,(H,26,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 72n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188843
PNG
(8-(1-phenyl-cyclohexyl)-4-propyl-2,8-diaza-spiro[4...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C23H34N2O/c1-2-9-20-18-24-21(26)22(20)14-16-25(17-15-22)23(12-7-4-8-13-23)19-10-5-3-6-11-19/h3,5-6,10-11,20H,2,4,7-9,12-18H2,1H3,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 82n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188871
PNG
(4-(4-fluoro-phenyl)-8-(1-p-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-5-9-22(10-6-20)27(13-3-2-4-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-7-11-23(28)12-8-21/h5-12,24H,2-4,13-19H2,1H3,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 419n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188870
PNG
(4-phenyl-8-(4-phenyl-tetrahydro-pyran-4-yl)-2,8-di...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCOCC1)c1ccccc1
Show InChI InChI=1S/C25H30N2O2/c28-23-24(22(19-26-23)20-7-3-1-4-8-20)11-15-27(16-12-24)25(13-17-29-18-14-25)21-9-5-2-6-10-21/h1-10,22H,11-19H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188853
PNG
(4-(4-fluoro-phenyl)-8-(1-thiophen-2-yl-cyclohexyl)...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccs1
Show InChI InChI=1S/C24H29FN2OS/c25-19-8-6-18(7-9-19)20-17-26-22(28)23(20)12-14-27(15-13-23)24(10-2-1-3-11-24)21-5-4-16-29-21/h4-9,16,20H,1-3,10-15,17H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 67n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 810n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188876
PNG
(8-[1-(3-methoxy-phenyl)-cyclohexyl]-4-phenyl-2,8-d...)
Show SMILES COc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O2/c1-31-23-12-8-11-22(19-23)27(13-6-3-7-14-27)29-17-15-26(16-18-29)24(20-28-25(26)30)21-9-4-2-5-10-21/h2,4-5,8-12,19,24H,3,6-7,13-18,20H2,1H3,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.61E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188855
PNG
(1-phenyl-8-(1-phenyl-cyclohexyl)-1,3,8-triaza-spir...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C25H31N3O/c29-23-25(28(20-26-23)22-12-6-2-7-13-22)16-18-27(19-17-25)24(14-8-3-9-15-24)21-10-4-1-5-11-21/h1-2,4-7,10-13H,3,8-9,14-20H2,(H,26,29)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188865
PNG
(CHEMBL211158 | rac-8-(1-cyclopropyl-cyclohexyl)-4-...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)C1CC1
Show InChI InChI=1S/C23H31FN2O/c24-19-8-4-17(5-9-19)20-16-25-21(27)22(20)12-14-26(15-13-22)23(18-6-7-18)10-2-1-3-11-23/h4-5,8-9,18,20H,1-3,6-7,10-16H2,(H,25,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188879
PNG
(CHEMBL214057 | rac-8-[1-(4-fluoro-phenyl)-cyclohex...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C23H33FN2O/c1-2-6-19-17-25-21(27)22(19)13-15-26(16-14-22)23(11-4-3-5-12-23)18-7-9-20(24)10-8-18/h7-10,19H,2-6,11-17H2,1H3,(H,25,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 93n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188885
PNG
(CHEMBL209947 | rac-8-[1-(4-fluoro-phenyl)-cyclohex...)
Show SMILES Fc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H30F4N2O/c28-22-10-8-20(9-11-22)26(12-2-1-3-13-26)33-16-14-25(15-17-33)23(18-32-24(25)34)19-4-6-21(7-5-19)27(29,30)31/h4-11,23H,1-3,12-18H2,(H,32,34)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 433n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188843
PNG
(8-(1-phenyl-cyclohexyl)-4-propyl-2,8-diaza-spiro[4...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C23H34N2O/c1-2-9-20-18-24-21(26)22(20)14-16-25(17-15-22)23(12-7-4-8-13-23)19-10-5-3-6-11-19/h3,5-6,10-11,20H,2,4,7-9,12-18H2,1H3,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 62n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188846
PNG
(4-phenyl-8-[1-(4-trifluoromethyl-phenyl)-cyclohexy...)
Show SMILES FC(F)(F)c1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H31F3N2O/c28-27(29,30)22-11-9-21(10-12-22)26(13-5-2-6-14-26)32-17-15-25(16-18-32)23(19-31-24(25)33)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,31,33)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.21E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188851
PNG
(CHEMBL211525 | rac-4-(4-fluoro-phenyl)-8-(1-isopro...)
Show SMILES CC(C)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C23H33FN2O/c1-17(2)23(10-4-3-5-11-23)26-14-12-22(13-15-26)20(16-25-21(22)27)18-6-8-19(24)9-7-18/h6-9,17,20H,3-5,10-16H2,1-2H3,(H,25,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 787n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188874
PNG
(CHEMBL384498 | rac-4-phenyl-8-(1-thiophen-3-yl-cyc...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccsc1
Show InChI InChI=1S/C24H30N2OS/c27-22-23(21(17-25-22)19-7-3-1-4-8-19)12-14-26(15-13-23)24(10-5-2-6-11-24)20-9-16-28-18-20/h1,3-4,7-9,16,18,21H,2,5-6,10-15,17H2,(H,25,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 682n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188867
PNG
(4-phenyl-8-(3-phenyl-tetrahydro-pyran-3-yl)-2,8-di...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCOC1)c1ccccc1
Show InChI InChI=1S/C25H30N2O2/c28-23-24(22(18-26-23)20-8-3-1-4-9-20)13-15-27(16-14-24)25(12-7-17-29-19-25)21-10-5-2-6-11-21/h1-6,8-11,22H,7,12-19H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.42E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188883
PNG
(CHEMBL378285 | rac-8-(1-phenyl-cyclohexyl)-4-p-tol...)
Show SMILES Cc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-22(13-11-21)24-20-28-25(30)26(24)16-18-29(19-17-26)27(14-6-3-7-15-27)23-8-4-2-5-9-23/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 139n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188887
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclobu...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCC1)c1ccc(F)cc1
Show InChI InChI=1S/C24H26F2N2O/c25-19-6-2-17(3-7-19)21-16-27-22(29)23(21)12-14-28(15-13-23)24(10-1-11-24)18-4-8-20(26)9-5-18/h2-9,21H,1,10-16H2,(H,27,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 284n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 684n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188858
PNG
(4-(4-fluoro-phenyl)-8-(1-thiophen-3-yl-cyclohexyl)...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccsc1
Show InChI InChI=1S/C24H29FN2OS/c25-20-6-4-18(5-7-20)21-16-26-22(28)23(21)11-13-27(14-12-23)24(9-2-1-3-10-24)19-8-15-29-17-19/h4-8,15,17,21H,1-3,9-14,16H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 99n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188871
PNG
(4-(4-fluoro-phenyl)-8-(1-p-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-5-9-22(10-6-20)27(13-3-2-4-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-7-11-23(28)12-8-21/h5-12,24H,2-4,13-19H2,1H3,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 419n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188850
PNG
(CHEMBL426502 | rac-8-bicyclohexyl-1-yl-4-phenyl-2,...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)C1CCCCC1
Show InChI InChI=1S/C26H38N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1,4-5,10-11,22-23H,2-3,6-9,12-20H2,(H,27,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.52E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188862
PNG
(CHEMBL377350 | rac-8-[1-(2-methyl-propenyl)-cycloh...)
Show SMILES CC(C)=CC1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C24H34N2O/c1-19(2)17-23(11-7-4-8-12-23)26-15-13-24(14-16-26)21(18-25-22(24)27)20-9-5-3-6-10-20/h3,5-6,9-10,17,21H,4,7-8,11-16,18H2,1-2H3,(H,25,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 979n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188876
PNG
(8-[1-(3-methoxy-phenyl)-cyclohexyl]-4-phenyl-2,8-d...)
Show SMILES COc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O2/c1-31-23-12-8-11-22(19-23)27(13-6-3-7-14-27)29-17-15-26(16-18-29)24(20-28-25(26)30)21-9-4-2-5-10-21/h2,4-5,8-12,19,24H,3,6-7,13-18,20H2,1H3,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.61E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188875
PNG
(CHEMBL378848 | rac-4-propyl-8-(1-thiophen-2-yl-cyc...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccs1
Show InChI InChI=1S/C21H32N2OS/c1-2-7-17-16-22-19(24)20(17)11-13-23(14-12-20)21(9-4-3-5-10-21)18-8-6-15-25-18/h6,8,15,17H,2-5,7,9-14,16H2,1H3,(H,22,24)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 229n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188857
PNG
(8-[1-(3-fluoro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Fc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31FN2O/c27-22-11-7-10-21(18-22)26(12-5-2-6-13-26)29-16-14-25(15-17-29)23(19-28-24(25)30)20-8-3-1-4-9-20/h1,3-4,7-11,18,23H,2,5-6,12-17,19H2,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 684n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 949n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188844
PNG
(4-phenyl-8-(1-phenyl-cyclohexyl)-2,8-diaza-spiro[4...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C26H32N2O/c29-24-25(23(20-27-24)21-10-4-1-5-11-21)16-18-28(19-17-25)26(14-8-3-9-15-26)22-12-6-2-7-13-22/h1-2,4-7,10-13,23H,3,8-9,14-20H2,(H,27,29)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 77n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188853
PNG
(4-(4-fluoro-phenyl)-8-(1-thiophen-2-yl-cyclohexyl)...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccs1
Show InChI InChI=1S/C24H29FN2OS/c25-19-8-6-18(7-9-19)20-17-26-22(28)23(20)12-14-27(15-13-23)24(10-2-1-3-11-24)21-5-4-16-29-21/h4-9,16,20H,1-3,10-15,17H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 281n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188863
PNG
(CHEMBL436752 | rac-4-(4-fluoro-phenyl)-8-[1-(3-flu...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(F)c1
Show InChI InChI=1S/C26H30F2N2O/c27-21-9-7-19(8-10-21)23-18-29-24(31)25(23)13-15-30(16-14-25)26(11-2-1-3-12-26)20-5-4-6-22(28)17-20/h4-10,17,23H,1-3,11-16,18H2,(H,29,31)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 949n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188854
PNG
(4-(4-fluoro-phenyl)-8-[1-(3-trifluoromethoxy-pheny...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C27H30F4N2O2/c28-21-9-7-19(8-10-21)23-18-32-24(34)25(23)13-15-33(16-14-25)26(11-2-1-3-12-26)20-5-4-6-22(17-20)35-27(29,30)31/h4-10,17,23H,1-3,11-16,18H2,(H,32,34)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.15E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188864
PNG
(CHEMBL445398 | rac-8-(1-ethyl-cyclohexyl)-4-(4-flu...)
Show SMILES CCC1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C22H31FN2O/c1-2-21(10-4-3-5-11-21)25-14-12-22(13-15-25)19(16-24-20(22)26)17-6-8-18(23)9-7-17/h6-9,19H,2-5,10-16H2,1H3,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.47E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188873
PNG
(CHEMBL377109 | rac-8-(1-isopropyl-cyclohexyl)-4-ph...)
Show SMILES CC(C)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C23H34N2O/c1-18(2)23(11-7-4-8-12-23)25-15-13-22(14-16-25)20(17-24-21(22)26)19-9-5-3-6-10-19/h3,5-6,9-10,18,20H,4,7-8,11-17H2,1-2H3,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 970n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188886
PNG
(CHEMBL380037 | rac-4-phenyl-8-(1-thiophen-2-yl-cyc...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1cccs1
Show InChI InChI=1S/C24H30N2OS/c27-22-23(20(18-25-22)19-8-3-1-4-9-19)13-15-26(16-14-23)24(11-5-2-6-12-24)21-10-7-17-28-21/h1,3-4,7-10,17,20H,2,5-6,11-16,18H2,(H,25,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 147n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188868
PNG
(4-[1-(1-oxo-4-phenyl-2,8-diaza-spiro[4.5]dec-8-yl)...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H31N3O/c28-19-21-9-11-23(12-10-21)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(20-29-25(26)31)22-7-3-1-4-8-22/h1,3-4,7-12,24H,2,5-6,13-18,20H2,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188845
PNG
(4-(4-fluoro-phenyl)-8-(1-m-tolyl-cyclohexyl)-2,8-d...)
Show SMILES Cc1cccc(c1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-6-5-7-22(18-20)27(12-3-2-4-13-27)30-16-14-26(15-17-30)24(19-29-25(26)31)21-8-10-23(28)11-9-21/h5-11,18,24H,2-4,12-17,19H2,1H3,(H,29,31)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188846
PNG
(4-phenyl-8-[1-(4-trifluoromethyl-phenyl)-cyclohexy...)
Show SMILES FC(F)(F)c1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H31F3N2O/c28-27(29,30)22-11-9-21(10-12-22)26(13-5-2-6-14-26)32-17-15-25(16-18-32)23(19-31-24(25)33)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,31,33)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.97E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188869
PNG
(CHEMBL213353 | rac-8-(1-cyclopropyl-cyclohexyl)-4-...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)C1CC1
Show InChI InChI=1S/C23H32N2O/c26-21-22(20(17-24-21)18-7-3-1-4-8-18)13-15-25(16-14-22)23(19-9-10-19)11-5-2-6-12-23/h1,3-4,7-8,19-20H,2,5-6,9-17H2,(H,24,26)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188858
PNG
(4-(4-fluoro-phenyl)-8-(1-thiophen-3-yl-cyclohexyl)...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccsc1
Show InChI InChI=1S/C24H29FN2OS/c25-20-6-4-18(5-7-20)21-16-26-22(28)23(21)11-13-27(14-12-23)24(9-2-1-3-10-24)19-8-15-29-17-19/h4-8,15,17,21H,1-3,9-14,16H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 99n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188859
PNG
(CHEMBL378665 | rac-4-(4-fluoro-phenyl)-8-(1-o-toly...)
Show SMILES Cc1ccccc1C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-7-3-4-8-23(20)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-9-11-22(28)12-10-21/h3-4,7-12,24H,2,5-6,13-19H2,1H3,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 350n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188863
PNG
(CHEMBL436752 | rac-4-(4-fluoro-phenyl)-8-[1-(3-flu...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(F)c1
Show InChI InChI=1S/C26H30F2N2O/c27-21-9-7-19(8-10-21)23-18-29-24(31)25(23)13-15-30(16-14-25)26(11-2-1-3-12-26)20-5-4-6-22(28)17-20/h4-10,17,23H,1-3,11-16,18H2,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 393n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 56n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188856
PNG
(8-[1-(4-chloro-phenyl)-cyclohexyl]-4-phenyl-2,8-di...)
Show SMILES Clc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C26H31ClN2O/c27-22-11-9-21(10-12-22)26(13-5-2-6-14-26)29-17-15-25(16-18-29)23(19-28-24(25)30)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,28,30)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188854
PNG
(4-(4-fluoro-phenyl)-8-[1-(3-trifluoromethoxy-pheny...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C27H30F4N2O2/c28-21-9-7-19(8-10-21)23-18-32-24(34)25(23)13-15-33(16-14-25)26(11-2-1-3-12-26)20-5-4-6-22(17-20)35-27(29,30)31/h4-10,17,23H,1-3,11-16,18H2,(H,32,34)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.15E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188870
PNG
(4-phenyl-8-(4-phenyl-tetrahydro-pyran-4-yl)-2,8-di...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCOCC1)c1ccccc1
Show InChI InChI=1S/C25H30N2O2/c28-23-24(22(19-26-23)20-7-3-1-4-8-20)11-15-27(16-12-24)25(13-17-29-18-14-25)21-9-5-2-6-10-21/h1-10,22H,11-19H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 95n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188882
PNG
(CHEMBL384202 | rac-4-phenyl-8-[1-(4-trifluorometho...)
Show SMILES FC(F)(F)Oc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H31F3N2O2/c28-27(29,30)34-22-11-9-21(10-12-22)26(13-5-2-6-14-26)32-17-15-25(16-18-32)23(19-31-24(25)33)20-7-3-1-4-8-20/h1,3-4,7-12,23H,2,5-6,13-19H2,(H,31,33)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 4.56E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 2


(HUMAN)
BDBM50188859
PNG
(CHEMBL378665 | rac-4-(4-fluoro-phenyl)-8-(1-o-toly...)
Show SMILES Cc1ccccc1C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-7-3-4-8-23(20)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(19-29-25(26)31)21-9-11-22(28)12-10-21/h3-4,7-12,24H,2,5-6,13-19H2,1H3,(H,29,31)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT2


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188861
PNG
(4-phenyl-8-(1-p-tolyl-cyclohexyl)-2,8-diaza-spiro[...)
Show SMILES Cc1ccc(cc1)C1(CCCCC1)N1CCC2(CC1)C(CNC2=O)c1ccccc1
Show InChI InChI=1S/C27H34N2O/c1-21-10-12-23(13-11-21)27(14-6-3-7-15-27)29-18-16-26(17-19-29)24(20-28-25(26)30)22-8-4-2-5-9-22/h2,4-5,8-13,24H,3,6-7,14-20H2,1H3,(H,28,30)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 284n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188849
PNG
(4-(4-fluoro-phenyl)-8-[1-(4-fluoro-phenyl)-cyclohe...)
Show SMILES Fc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C26H30F2N2O/c27-21-8-4-19(5-9-21)23-18-29-24(31)25(23)14-16-30(17-15-25)26(12-2-1-3-13-26)20-6-10-22(28)11-7-20/h4-11,23H,1-3,12-18H2,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 95n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188848
PNG
(CHEMBL213080 | rac-8-(1-cyclopentyl-cyclohexyl)-4-...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)C1CCCC1
Show InChI InChI=1S/C25H36N2O/c28-23-24(22(19-26-23)20-9-3-1-4-10-20)15-17-27(18-16-24)25(13-7-2-8-14-25)21-11-5-6-12-21/h1,3-4,9-10,21-22H,2,5-8,11-19H2,(H,26,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.29E+3n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188868
PNG
(4-[1-(1-oxo-4-phenyl-2,8-diaza-spiro[4.5]dec-8-yl)...)
Show SMILES O=C1NCC(c2ccccc2)C11CCN(CC1)C1(CCCCC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H31N3O/c28-19-21-9-11-23(12-10-21)27(13-5-2-6-14-27)30-17-15-26(16-18-30)24(20-29-25(26)31)22-7-3-1-4-8-22/h1,3-4,7-12,24H,2,5-6,13-18,20H2,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188877
PNG
(CHEMBL386703 | rac-8-[1-(5-methyl-thiophen-2-yl)-c...)
Show SMILES CCCC1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(C)s1
Show InChI InChI=1S/C22H34N2OS/c1-3-7-18-16-23-20(25)21(18)12-14-24(15-13-21)22(10-5-4-6-11-22)19-9-8-17(2)26-19/h8-9,18H,3-7,10-16H2,1-2H3,(H,23,25)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 113n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50188884
PNG
(CHEMBL212441 | rac-8-[1-(4-fluoro-phenyl)-cyclohex...)
Show SMILES Cc1ccc(cc1)C1CNC(=O)C11CCN(CC1)C1(CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C27H33FN2O/c1-20-5-7-21(8-6-20)24-19-29-25(31)26(24)15-17-30(18-16-26)27(13-3-2-4-14-27)22-9-11-23(28)12-10-22/h5-12,24H,2-4,13-19H2,1H3,(H,29,31)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 73n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at GlyT1


Bioorg Med Chem Lett 16: 4321-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.063
BindingDB Entry DOI: 10.7270/Q2P26ZXG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%