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Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with Target = 'GABA receptor rho-2 subunit' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50211642
PNG
(CHEMBL397209 | Methyl(1,2,3,6-tetrahydropyridinium...)
Show SMILES CP(O)(=O)C1=CCNCC1
Show InChI InChI=1S/C6H12NO2P/c1-10(8,9)6-2-4-7-5-3-6/h2,7H,3-5H2,1H3,(H,8,9)
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n/an/a 2.21E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant GABAc rho-2 receptor expressed in Xenopus laevis oocytes assessed as inhibition of GABA-induced current by t...


Citation and Details
More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50336850
PNG
(3-(guanido)-1-oxo-1-hydroxy-phospholane | CHEMBL16...)
Show SMILES NC(N)=NC1CCP(O)(O)=C1
Show InChI InChI=1S/C5H12N3O2P/c6-5(7)8-4-1-2-11(9,10)3-4/h3-4,9-10H,1-2H2,(H4,6,7,8)
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Article
n/an/a 5.13E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant GABAc rho-2 receptor expressed in Xenopus laevis oocytes assessed as inhibition of GABA-induced current by t...


Citation and Details
More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50336851
PNG
(3-(aminomethyl)-1-oxo-1-hydroxy-phospholane | CHEM...)
Show SMILES NCC1CCP(O)(O)=C1
Show InChI InChI=1S/C5H12NO2P/c6-3-5-1-2-9(7,8)4-5/h4-5,7-8H,1-3,6H2
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n/an/a 5.71E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant GABAc rho-2 receptor expressed in Xenopus laevis oocytes assessed as inhibition of GABA-induced current by t...


Citation and Details
More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50087269
PNG
((cis)-2-Aminomethyl-cyclopropanecarboxylic acid | ...)
Show SMILES NCC1CC1C(O)=O
Show InChI InChI=1S/C5H9NO2/c6-2-3-1-4(3)5(7)8/h3-4H,1-2,6H2,(H,7,8)
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n/an/an/an/a 3.45E+4n/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Full agonist activity against human rho-2 subunit GABA-C receptor expressed in Xenopus oocytes


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM23183
PNG
(5-(aminomethyl)-1,2-oxazol-3-ol | Agarin | CHEMBL2...)
Show SMILES NCc1cc(=O)[nH]o1
Show InChI InChI=1S/C4H6N2O2/c5-2-3-1-4(7)6-8-3/h1H,2,5H2,(H,6,7)
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n/an/an/a 1.40E+3n/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Partial agonist activity against human rho-2 subunit GABA-C receptor expressed in Xenopus oocytes


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50087277
PNG
((Z)-4-Amino-but-2-enoic acid | (Z)-4-aminobut-2-en...)
Show SMILES NC\C=C/C(O)=O
Show InChI InChI=1S/C4H7NO2/c5-3-1-2-4(6)7/h1-2H,3,5H2,(H,6,7)/b2-1-
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n/an/an/an/a 7.00E+4n/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Partial agonist activity againast human rho-2 subunit GABA-C receptor expressed in Xenopus oocytes


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50087271
PNG
((E)-4-Amino-but-2-enoic acid (TACA) | 4-Amino-but-...)
Show SMILES NC\C=C\C(O)=O
Show InChI InChI=1S/C4H7NO2/c5-3-1-2-4(6)7/h1-2H,3,5H2,(H,6,7)/b2-1+
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n/an/an/an/a 400n/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Partial agonist activity against homomeric rho-2 subunit GABA-C receptor expressed in Xenopus oocytes


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM85712
PNG
(1H-imidazol-4-ylacetic acid | CAS_645-65-8 | CHEMB...)
Show SMILES OC(=O)Cc1cnc[nH]1
Show InChI InChI=1S/C5H6N2O2/c8-5(9)1-4-2-6-3-7-4/h2-3H,1H2,(H,6,7)(H,8,9)
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PubMed
n/an/an/an/a 3.00E+3n/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Partial agonist activity against human rho-2 subunit GABA-C receptor expressed in Xenopus oocytes


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50087274
PNG
(4-Amino-2-methyl-but-2-enoic acid (2-MeTACA) | 4-a...)
Show SMILES C\C(=C/CN)C(O)=O
Show InChI InChI=1S/C5H9NO2/c1-4(2-3-6)5(7)8/h2H,3,6H2,1H3,(H,7,8)/b4-2+
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n/an/an/an/a 1.01E+5n/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Activation of human rho2 GABA-C receptor at 34% of maximal GABA-induced response


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair
GABA receptor rho-2 subunit


(Homo sapiens)
BDBM50087269
PNG
((cis)-2-Aminomethyl-cyclopropanecarboxylic acid | ...)
Show SMILES NCC1CC1C(O)=O
Show InChI InChI=1S/C5H9NO2/c6-2-3-1-4(3)5(7)8/h3-4H,1-2,6H2,(H,7,8)
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n/an/an/an/a 1.75E+4n/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Partial agonist activity with low efficacy against rho-2 subunit GABA-C receptor expressed in Xenopus oocytes


J Med Chem 43: 1427-47 (2000)

More data for this
Ligand-Target Pair