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Compile Data Set for Download or QSAR

Found 70 hits with Last Name = 'jaroszewski' and Initial = 'jw'   
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
GRIA1


(Homo sapiens (Human))
BDBM50122077
PNG
(CHEMBL153017 | N-[1-[5-(6-Amino-hexylamino)-pentyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCNCCCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-5-8-17-26-16-7-4-3-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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3.30n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122093
PNG
(CHEMBL152879 | N-[1-[4-(7-Amino-heptylamino)-butyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCNCCCCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-8-17-26-16-7-5-3-4-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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38n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122084
PNG
(CHEMBL153996 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccncc1
Show InChI InChI=1S/C26H39N5O3/c27-14-7-16-28-15-5-3-1-2-4-6-17-30-26(34)24(20-21-8-10-23(32)11-9-21)31-25(33)22-12-18-29-19-13-22/h8-13,18-19,24,28,32H,1-7,14-17,20,27H2,(H,30,34)(H,31,33)
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64n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122090
PNG
(CHEMBL147182 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-8-6-4-3-5-7-16-26-17-9-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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65n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122096
PNG
(CHEMBL152410 | Hexanoic acid [1-[8-(3-amino-propyl...)
Show SMILES CCCCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C26H46N4O3/c1-2-3-8-12-25(32)30-24(21-22-13-15-23(31)16-14-22)26(33)29-20-10-7-5-4-6-9-18-28-19-11-17-27/h13-16,24,28,31H,2-12,17-21,27H2,1H3,(H,29,33)(H,30,32)
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68n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122087
PNG
(CHEMBL153995 | Cyclohexanecarboxylic acid [1-[8-(3...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)C1CCCCC1
Show InChI InChI=1S/C27H46N4O3/c28-17-10-19-29-18-8-3-1-2-4-9-20-30-27(34)25(21-22-13-15-24(32)16-14-22)31-26(33)23-11-6-5-7-12-23/h13-16,23,25,29,32H,1-12,17-21,28H2,(H,30,34)(H,31,33)
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78n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122085
PNG
(CHEMBL152425 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1cccnc1
Show InChI InChI=1S/C26H39N5O3/c27-14-8-17-28-15-5-3-1-2-4-6-18-30-26(34)24(19-21-10-12-23(32)13-11-21)31-25(33)22-9-7-16-29-20-22/h7,9-13,16,20,24,28,32H,1-6,8,14-15,17-19,27H2,(H,30,34)(H,31,33)
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88n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122086
PNG
(CHEMBL269192 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES CC(C)(C)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C25H44N4O3/c1-25(2,3)24(32)29-22(19-20-11-13-21(30)14-12-20)23(31)28-18-9-7-5-4-6-8-16-27-17-10-15-26/h11-14,22,27,30H,4-10,15-19,26H2,1-3H3,(H,28,31)(H,29,32)
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90n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122095
PNG
(CHEMBL355977 | N-[8-(3-Amino-propylamino)-octyl]-3...)
Show SMILES CCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C23H40N4O3/c1-2-22(29)27-21(18-19-10-12-20(28)13-11-19)23(30)26-17-8-6-4-3-5-7-15-25-16-9-14-24/h10-13,21,25,28H,2-9,14-18,24H2,1H3,(H,26,30)(H,27,29)
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100n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122091
PNG
(CHEMBL152736 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C29H42N4O3/c30-19-10-21-31-20-8-3-1-2-4-9-22-32-29(36)27(23-25-13-16-26(34)17-14-25)33-28(35)18-15-24-11-6-5-7-12-24/h5-7,11-18,27,31,34H,1-4,8-10,19-23,30H2,(H,32,36)(H,33,35)/b18-15+
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110n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122092
PNG
(CHEMBL350228 | N-[8-(3-Amino-propylamino)-octyl]-3...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C28H42N4O3/c29-17-10-19-30-18-8-3-1-2-4-9-20-31-28(35)26(21-24-13-15-25(33)16-14-24)32-27(34)22-23-11-6-5-7-12-23/h5-7,11-16,26,30,33H,1-4,8-10,17-22,29H2,(H,31,35)(H,32,34)
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110n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122089
PNG
(CHEMBL352030 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccccc1
Show InChI InChI=1S/C27H40N4O3/c28-17-10-19-29-18-8-3-1-2-4-9-20-30-27(34)25(21-22-13-15-24(32)16-14-22)31-26(33)23-11-6-5-7-12-23/h5-7,11-16,25,29,32H,1-4,8-10,17-21,28H2,(H,30,34)(H,31,33)
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130n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122094
PNG
(CHEMBL345521 | Pyridine-2-carboxylic acid [1-[8-(3...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccccn1
Show InChI InChI=1S/C26H39N5O3/c27-15-9-17-28-16-6-3-1-2-4-7-19-30-25(33)24(20-21-11-13-22(32)14-12-21)31-26(34)23-10-5-8-18-29-23/h5,8,10-14,18,24,28,32H,1-4,6-7,9,15-17,19-20,27H2,(H,30,33)(H,31,34)
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130n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122093
PNG
(CHEMBL152879 | N-[1-[4-(7-Amino-heptylamino)-butyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCNCCCCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-8-17-26-16-7-5-3-4-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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135n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122086
PNG
(CHEMBL269192 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES CC(C)(C)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C25H44N4O3/c1-25(2,3)24(32)29-22(19-20-11-13-21(30)14-12-20)23(31)28-18-9-7-5-4-6-8-16-27-17-10-15-26/h11-14,22,27,30H,4-10,15-19,26H2,1-3H3,(H,28,31)(H,29,32)
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140n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122078
PNG
(CHEMBL422515 | N-[1-[7-(4-Amino-butylamino)-heptyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCNCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-8-5-3-4-7-16-26-17-9-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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168n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122094
PNG
(CHEMBL345521 | Pyridine-2-carboxylic acid [1-[8-(3...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccccn1
Show InChI InChI=1S/C26H39N5O3/c27-15-9-17-28-16-6-3-1-2-4-7-19-30-25(33)24(20-21-11-13-22(32)14-12-21)31-26(34)23-10-5-8-18-29-23/h5,8,10-14,18,24,28,32H,1-4,6-7,9,15-17,19-20,27H2,(H,30,33)(H,31,34)
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170n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122091
PNG
(CHEMBL152736 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C29H42N4O3/c30-19-10-21-31-20-8-3-1-2-4-9-22-32-29(36)27(23-25-13-16-26(34)17-14-25)33-28(35)18-15-24-11-6-5-7-12-24/h5-7,11-18,27,31,34H,1-4,8-10,19-23,30H2,(H,32,36)(H,33,35)/b18-15+
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170n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122085
PNG
(CHEMBL152425 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1cccnc1
Show InChI InChI=1S/C26H39N5O3/c27-14-8-17-28-15-5-3-1-2-4-6-18-30-26(34)24(19-21-10-12-23(32)13-11-21)31-25(33)22-9-7-16-29-20-22/h7,9-13,16,20,24,28,32H,1-6,8,14-15,17-19,27H2,(H,30,34)(H,31,33)
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210n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122081
PNG
(2-Acetylamino-N-[8-(3-amino-propylamino)-octyl]-3-...)
Show SMILES CC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C22H38N4O3/c1-18(27)26-21(17-19-9-11-20(28)12-10-19)22(29)25-16-7-5-3-2-4-6-14-24-15-8-13-23/h9-12,21,24,28H,2-8,13-17,23H2,1H3,(H,25,29)(H,26,27)
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220n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122087
PNG
(CHEMBL153995 | Cyclohexanecarboxylic acid [1-[8-(3...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)C1CCCCC1
Show InChI InChI=1S/C27H46N4O3/c28-17-10-19-29-18-8-3-1-2-4-9-20-30-27(34)25(21-22-13-15-24(32)16-14-22)31-26(33)23-11-6-5-7-12-23/h13-16,23,25,29,32H,1-12,17-21,28H2,(H,30,34)(H,31,33)
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240n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122089
PNG
(CHEMBL352030 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccccc1
Show InChI InChI=1S/C27H40N4O3/c28-17-10-19-29-18-8-3-1-2-4-9-20-30-27(34)25(21-22-13-15-24(32)16-14-22)31-26(33)23-11-6-5-7-12-23/h5-7,11-16,25,29,32H,1-4,8-10,17-21,28H2,(H,30,34)(H,31,33)
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250n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122083
PNG
(CHEMBL154012 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCc1ccccc1
Show InChI InChI=1S/C29H44N4O3/c30-19-10-21-31-20-8-3-1-2-4-9-22-32-29(36)27(23-25-13-16-26(34)17-14-25)33-28(35)18-15-24-11-6-5-7-12-24/h5-7,11-14,16-17,27,31,34H,1-4,8-10,15,18-23,30H2,(H,32,36)(H,33,35)
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250n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122092
PNG
(CHEMBL350228 | N-[8-(3-Amino-propylamino)-octyl]-3...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C28H42N4O3/c29-17-10-19-30-18-8-3-1-2-4-9-20-31-28(35)26(21-24-13-15-25(33)16-14-24)32-27(34)22-23-11-6-5-7-12-23/h5-7,11-16,26,30,33H,1-4,8-10,17-22,29H2,(H,31,35)(H,32,34)
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250n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122083
PNG
(CHEMBL154012 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCc1ccccc1
Show InChI InChI=1S/C29H44N4O3/c30-19-10-21-31-20-8-3-1-2-4-9-22-32-29(36)27(23-25-13-16-26(34)17-14-25)33-28(35)18-15-24-11-6-5-7-12-24/h5-7,11-14,16-17,27,31,34H,1-4,8-10,15,18-23,30H2,(H,32,36)(H,33,35)
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254n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122095
PNG
(CHEMBL355977 | N-[8-(3-Amino-propylamino)-octyl]-3...)
Show SMILES CCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C23H40N4O3/c1-2-22(29)27-21(18-19-10-12-20(28)13-11-19)23(30)26-17-8-6-4-3-5-7-15-25-16-9-14-24/h10-13,21,25,28H,2-9,14-18,24H2,1H3,(H,26,30)(H,27,29)
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280n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122077
PNG
(CHEMBL153017 | N-[1-[5-(6-Amino-hexylamino)-pentyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCNCCCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-5-8-17-26-16-7-4-3-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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287n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122081
PNG
(2-Acetylamino-N-[8-(3-amino-propylamino)-octyl]-3-...)
Show SMILES CC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C22H38N4O3/c1-18(27)26-21(17-19-9-11-20(28)12-10-19)22(29)25-16-7-5-3-2-4-6-14-24-15-8-13-23/h9-12,21,24,28H,2-8,13-17,23H2,1H3,(H,25,29)(H,26,27)
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300n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122084
PNG
(CHEMBL153996 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES NCCCNCCCCCCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccncc1
Show InChI InChI=1S/C26H39N5O3/c27-14-7-16-28-15-5-3-1-2-4-6-17-30-26(34)24(20-21-8-10-23(32)11-9-21)31-25(33)22-12-18-29-19-13-22/h8-13,18-19,24,28,32H,1-7,14-17,20,27H2,(H,30,34)(H,31,33)
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330n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122079
PNG
(CHEMBL154184 | N-[2-[3-(8-Amino-octylamino)-propyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(O)NCCCNCCCCCCCCN
Show InChI InChI=1S/C24H44N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-17-26-16-8-6-4-3-5-7-15-25/h11-14,22,24,26-27,29,31H,2-10,15-19,25H2,1H3,(H,28,30)
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350n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122082
PNG
(CHEMBL434273 | N-[1-[9-(2-Amino-ethylamino)-nonylc...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCCNCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-17-9-7-5-3-4-6-8-16-26-18-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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410n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122080
PNG
(CHEMBL152153 | N-[1-[6-(5-Amino-pentylamino)-hexyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCNCCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-4-3-7-16-26-17-8-5-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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468n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122096
PNG
(CHEMBL152410 | Hexanoic acid [1-[8-(3-amino-propyl...)
Show SMILES CCCCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C26H46N4O3/c1-2-3-8-12-25(32)30-24(21-22-13-15-23(31)16-14-22)26(33)29-20-10-7-5-4-6-9-18-28-19-11-17-27/h13-16,24,28,31H,2-12,17-21,27H2,1H3,(H,29,33)(H,30,32)
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1.00E+3n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122078
PNG
(CHEMBL422515 | N-[1-[7-(4-Amino-butylamino)-heptyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCNCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-8-5-3-4-7-16-26-17-9-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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3.00E+3n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122082
PNG
(CHEMBL434273 | N-[1-[9-(2-Amino-ethylamino)-nonylc...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCCNCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-17-9-7-5-3-4-6-8-16-26-18-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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6.20E+3n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122090
PNG
(CHEMBL147182 | N-[1-[8-(3-Amino-propylamino)-octyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-8-6-4-3-5-7-16-26-17-9-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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8.00E+3n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122079
PNG
(CHEMBL154184 | N-[2-[3-(8-Amino-octylamino)-propyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(O)NCCCNCCCCCCCCN
Show InChI InChI=1S/C24H44N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-17-26-16-8-6-4-3-5-7-15-25/h11-14,22,24,26-27,29,31H,2-10,15-19,25H2,1H3,(H,28,30)
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8.10E+3n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122080
PNG
(CHEMBL152153 | N-[1-[6-(5-Amino-pentylamino)-hexyl...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCNCCCCCN
Show InChI InChI=1S/C24H42N4O3/c1-2-10-23(30)28-22(19-20-11-13-21(29)14-12-20)24(31)27-18-9-4-3-7-16-26-17-8-5-6-15-25/h11-14,22,26,29H,2-10,15-19,25H2,1H3,(H,27,31)(H,28,30)
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>1.00E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122088
PNG
(CHEMBL55975 | N-[1-{3-[4-(3-Amino-propylamino)-but...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCNCCCCNCCCN
Show InChI InChI=1S/C23H41N5O3/c1-2-7-22(30)28-21(18-19-8-10-20(29)11-9-19)23(31)27-17-6-16-26-14-4-3-13-25-15-5-12-24/h8-11,21,25-26,29H,2-7,12-18,24H2,1H3,(H,27,31)(H,28,30)
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2.20E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-80 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
GRIA1


(Homo sapiens (Human))
BDBM50122088
PNG
(CHEMBL55975 | N-[1-{3-[4-(3-Amino-propylamino)-but...)
Show SMILES CCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCNCCCCNCCCN
Show InChI InChI=1S/C23H41N5O3/c1-2-7-22(30)28-21(18-19-8-10-20(29)11-9-19)23(31)27-17-6-16-26-14-4-3-13-25-15-5-12-24/h8-11,21,25-26,29H,2-7,12-18,24H2,1H3,(H,27,31)(H,28,30)
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1.70E+5n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of the (-40 mV) current elicited by 100 microM glutamate by simultaneous co-application in xenopus oocytes injected with GluR1 flop RNA.


J Med Chem 45: 5745-54 (2002)


BindingDB Entry DOI: 10.7270/Q2BP025P
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50329474
PNG
((S)-N-(1-(3-(4-(3-aminopropylamino)butylamino)prop...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CC1CCCCC1)NC(=O)C1CC1 |r|
Show InChI InChI=1S/C23H45N5O2/c24-12-6-15-25-13-4-5-14-26-16-7-17-27-23(30)21(28-22(29)20-10-11-20)18-19-8-2-1-3-9-19/h19-21,25-26H,1-18,24H2,(H,27,30)(H,28,29)/t21-/m0/s1
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n/an/a 11n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50329475
PNG
((S)-N-(1-(3-(4-(3-aminopropylamino)butylamino)prop...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CC1CCCCC1)NC(=O)C1CCCCC1 |r|
Show InChI InChI=1S/C26H51N5O2/c27-15-9-18-28-16-7-8-17-29-19-10-20-30-26(33)24(21-22-11-3-1-4-12-22)31-25(32)23-13-5-2-6-14-23/h22-24,28-29H,1-21,27H2,(H,30,33)(H,31,32)/t24-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50094298
PNG
(CHEMBL16117 | N-[(S)-1-{3-[4-(3-Amino-propylamino)...)
Show SMILES CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCNCCCCNCCCN
Show InChI InChI=1S/C23H41N5O3/c1-2-7-22(30)28-21(18-19-8-10-20(29)11-9-19)23(31)27-17-6-16-26-14-4-3-13-25-15-5-12-24/h8-11,21,25-26,29H,2-7,12-18,24H2,1H3,(H,27,31)(H,28,30)/t21-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50329473
PNG
((S)-N-(1-(3-(4-(3-aminopropylamino)butylamino)prop...)
Show SMILES CCCC(=O)N[C@@H](CC1CCCCC1)C(=O)NCCCNCCCCNCCCN |r|
Show InChI InChI=1S/C23H47N5O2/c1-2-10-22(29)28-21(19-20-11-4-3-5-12-20)23(30)27-18-9-17-26-15-7-6-14-25-16-8-13-24/h20-21,25-26H,2-19,24H2,1H3,(H,27,30)(H,28,29)/t21-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50329477
PNG
((S)-N-(3-(4-(3-aminopropylamino)butylamino)propyl)...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CC1CCCCC1)NC(=O)Cc1cccc2ccccc12 |r|
Show InChI InChI=1S/C31H49N5O2/c32-17-9-20-33-18-6-7-19-34-21-10-22-35-31(38)29(23-25-11-2-1-3-12-25)36-30(37)24-27-15-8-14-26-13-4-5-16-28(26)27/h4-5,8,13-16,25,29,33-34H,1-3,6-7,9-12,17-24,32H2,(H,35,38)(H,36,37)/t29-/m0/s1
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n/an/a 41n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Glutamate [NMDA] receptor subunit epsilon 1/zeta 1


(Homo sapiens (Human))
BDBM50329477
PNG
((S)-N-(3-(4-(3-aminopropylamino)butylamino)propyl)...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CC1CCCCC1)NC(=O)Cc1cccc2ccccc12 |r|
Show InChI InChI=1S/C31H49N5O2/c32-17-9-20-33-18-6-7-19-34-21-10-22-35-31(38)29(23-25-11-2-1-3-12-25)36-30(37)24-27-15-8-14-26-13-4-5-16-28(26)27/h4-5,8,13-16,25,29,33-34H,1-3,6-7,9-12,17-24,32H2,(H,35,38)(H,36,37)/t29-/m0/s1
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n/an/a 47n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at NR1-1a/NR2A receptor expressed in Xenopus laevis oocytes assessed as inhibition of glutamate/glycine-induced current at -60mV ...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50329476
PNG
((S)-N-(1-(3-(4-(3-aminopropylamino)butylamino)prop...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CC1CCCCC1)NC(=O)c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C32H49N5O2/c33-19-9-22-34-20-7-8-21-35-23-10-24-36-32(39)30(25-26-11-3-1-4-12-26)37-31(38)29-17-15-28(16-18-29)27-13-5-2-6-14-27/h2,5-6,13-18,26,30,34-35H,1,3-4,7-12,19-25,33H2,(H,36,39)(H,37,38)/t30-/m0/s1
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n/an/a 87n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50329478
PNG
((S)-2-(2-Adamantan-1-yl-acetylamino)-N-{3-[4-(3-am...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CC1CCCCC1)NC(=O)CC12CC3CC(CC(C3)C1)C2 |r,TLB:31:32:30.29.35:36,THB:31:30:32.37.33:36,33:32:29:35.34.36,33:34:31.32.37:29|
Show InChI InChI=1S/C31H57N5O2/c32-10-6-13-33-11-4-5-12-34-14-7-15-35-30(38)28(19-24-8-2-1-3-9-24)36-29(37)23-31-20-25-16-26(21-31)18-27(17-25)22-31/h24-28,33-34H,1-23,32H2,(H,35,38)(H,36,37)/t25?,26?,27?,28-,31?/m0/s1
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n/an/a 105n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at GluR1 expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced current at -60mV holding potential by tw...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Glutamate [NMDA] receptor subunit epsilon 1/zeta 1


(Homo sapiens (Human))
BDBM50329480
PNG
((S)-N-(20-amino-2,7-dioxo-1-phenyl-3,8,12,17-tetra...)
Show SMILES NCCCNCCCCNCCCNC(=O)[C@H](CCNC(=O)Cc1ccccc1)NC(=O)c1ccccc1 |r|
Show InChI InChI=1S/C29H44N6O3/c30-16-9-19-31-17-7-8-18-32-20-10-21-34-29(38)26(35-28(37)25-13-5-2-6-14-25)15-22-33-27(36)23-24-11-3-1-4-12-24/h1-6,11-14,26,31-32H,7-10,15-23,30H2,(H,33,36)(H,34,38)(H,35,37)/t26-/m0/s1
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n/an/a 106n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at NR1-1a/NR2A receptor expressed in Xenopus laevis oocytes assessed as inhibition of glutamate/glycine-induced current at -60mV ...


J Med Chem 53: 7441-51 (2010)


Article DOI: 10.1021/jm100886h
BindingDB Entry DOI: 10.7270/Q2125SX4
More data for this
Ligand-Target Pair
Muscle-type nicotinic acetylcholine receptor


(Homo sapiens (Human))
BDBM50111638
PNG
(CHEMBL16044 | N-[(S)-1-(11-Amino-undecylcarbamoyl)...)
Show SMILES CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCCCCCCCCN
Show InChI InChI=1S/C24H41N3O3/c1-2-12-23(29)27-22(19-20-13-15-21(28)16-14-20)24(30)26-18-11-9-7-5-3-4-6-8-10-17-25/h13-16,22,28H,2-12,17-19,25H2,1H3,(H,26,30)(H,27,29)/t22-/m0/s1
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n/an/a 460n/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibitory activity against human embryonic muscle type Nicotinic acetylcholine receptor specifically delta-subunit expres...


Bioorg Med Chem Lett 12: 1159-62 (2002)


BindingDB Entry DOI: 10.7270/Q2BC3XWG
More data for this
Ligand-Target Pair
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