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Compile Data Set for Download or QSAR

Found 140 hits with Last Name = 'froestl' and Initial = 'w'   
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
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM86283
PNG
(CAS_345-78-8 | CAS_39069-52-8 | GS 39783 | N,N'...)
Show SMILES CSc1nc(NC2CCCC2)c(c(NC2CCCC2)n1)[N+]([O-])=O
Show InChI InChI=1S/C15H23N5O2S/c1-23-15-18-13(16-10-6-2-3-7-10)12(20(21)22)14(19-15)17-11-8-4-5-9-11/h10-11H,2-9H2,1H3,(H2,16,17,18,19)
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PubMed
2.75n/an/an/an/an/an/an/an/a



Novartis Pharma AG

Curated by PDSP Ki Database




J Pharmacol Exp Ther 307: 322-30 (2003)


Article DOI: 10.1124/jpet.103.053074
BindingDB Entry DOI: 10.7270/Q2542M50
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM24184
PNG
((3-aminopropyl)phosphinic acid | 3-aminopropylphos...)
Show SMILES NCCCP(O)=O
Show InChI InChI=1S/C3H10NO2P/c4-2-1-3-7(5)6/h7H,1-4H2,(H,5,6)
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5n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM24185
PNG
((3-aminopropyl)(methyl)phosphinic acid | 3-Apmpa |...)
Show SMILES CP(O)(=O)CCCN
Show InChI InChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
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16n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM86283
PNG
(CAS_345-78-8 | CAS_39069-52-8 | GS 39783 | N,N'...)
Show SMILES CSc1nc(NC2CCCC2)c(c(NC2CCCC2)n1)[N+]([O-])=O
Show InChI InChI=1S/C15H23N5O2S/c1-23-15-18-13(16-10-6-2-3-7-10)12(20(21)22)14(19-15)17-11-8-4-5-9-11/h10-11H,2-9H2,1H3,(H2,16,17,18,19)
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32.4n/an/an/an/an/an/an/an/a



Novartis Pharma AG

Curated by PDSP Ki Database




J Pharmacol Exp Ther 307: 322-30 (2003)


Article DOI: 10.1124/jpet.103.053074
BindingDB Entry DOI: 10.7270/Q2542M50
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM24183
PNG
(4-amino-n-[2,3-3H]butyric acid | 4-aminobutanoic a...)
Show SMILES NCCCC(O)=O
Show InChI InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
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33n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM50032962
PNG
(((Z)-3-Amino-propenyl)-phosphinic acid | CGP38593 ...)
Show SMILES NCCCP(=O)=O
Show InChI InChI=1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2
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280n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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650n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM24185
PNG
((3-aminopropyl)(methyl)phosphinic acid | 3-Apmpa |...)
Show SMILES CP(O)(=O)CCCN
Show InChI InChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
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750n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM24184
PNG
((3-aminopropyl)phosphinic acid | 3-aminopropylphos...)
Show SMILES NCCCP(O)=O
Show InChI InChI=1S/C3H10NO2P/c4-2-1-3-7(5)6/h7H,1-4H2,(H,5,6)
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2.47E+3n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM50032962
PNG
(((Z)-3-Amino-propenyl)-phosphinic acid | CGP38593 ...)
Show SMILES NCCCP(=O)=O
Show InChI InChI=1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2
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4.40E+3n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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5.50E+3n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1


(Rattus norvegicus (Rat))
BDBM50032962
PNG
(((Z)-3-Amino-propenyl)-phosphinic acid | CGP38593 ...)
Show SMILES NCCCP(=O)=O
Show InChI InChI=1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2
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6.60E+3n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM50032962
PNG
(((Z)-3-Amino-propenyl)-phosphinic acid | CGP38593 ...)
Show SMILES NCCCP(=O)=O
Show InChI InChI=1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2
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7.70E+3n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM50032962
PNG
(((Z)-3-Amino-propenyl)-phosphinic acid | CGP38593 ...)
Show SMILES NCCCP(=O)=O
Show InChI InChI=1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1


(Rattus norvegicus (Rat))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3


(Homo sapiens (Human))
BDBM50032982
PNG
((3-Amino-propyl)-butyl-phosphinic acid | 3-aminopr...)
Show SMILES CCCCP(O)(=O)CCCN
Show InChI InChI=1S/C7H18NO2P/c1-2-3-6-11(9,10)7-4-5-8/h2-8H2,1H3,(H,9,10)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1


(Rattus norvegicus (Rat))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM50032982
PNG
((3-Amino-propyl)-butyl-phosphinic acid | 3-aminopr...)
Show SMILES CCCCP(O)(=O)CCCN
Show InChI InChI=1S/C7H18NO2P/c1-2-3-6-11(9,10)7-4-5-8/h2-8H2,1H3,(H,9,10)
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Sydney

Curated by PDSP Ki Database




Eur J Pharmacol 329: 223-9 (1997)


BindingDB Entry DOI: 10.7270/Q2H41PZV
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24185
PNG
((3-aminopropyl)(methyl)phosphinic acid | 3-Apmpa |...)
Show SMILES CP(O)(=O)CCCN
Show InChI InChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
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n/an/a 0.0160n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM24184
PNG
((3-aminopropyl)phosphinic acid | 3-aminopropylphos...)
Show SMILES NCCCP(O)=O
Show InChI InChI=1S/C3H10NO2P/c4-2-1-3-7(5)6/h7H,1-4H2,(H,5,6)
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n/an/a 2.40n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM24184
PNG
((3-aminopropyl)phosphinic acid | 3-aminopropylphos...)
Show SMILES NCCCP(O)=O
Show InChI InChI=1S/C3H10NO2P/c4-2-1-3-7(5)6/h7H,1-4H2,(H,5,6)
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n/an/a 5n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-CGP-27,492 to gamma-aminobutyric acid type B receptor of rat cortex.


J Med Chem 38: 3313-31 (1995)


BindingDB Entry DOI: 10.7270/Q2HD7TPZ
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24184
PNG
((3-aminopropyl)phosphinic acid | 3-aminopropylphos...)
Show SMILES NCCCP(O)=O
Show InChI InChI=1S/C3H10NO2P/c4-2-1-3-7(5)6/h7H,1-4H2,(H,5,6)
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n/an/a 5.40n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM24185
PNG
((3-aminopropyl)(methyl)phosphinic acid | 3-Apmpa |...)
Show SMILES CP(O)(=O)CCCN
Show InChI InChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
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n/an/a 6.60n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032964
PNG
((R)-4-Amino-3-(4-chloro-phenyl)-butyric acid | 4-A...)
Show SMILES NC[C@H](CC(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1


(Rattus norvegicus (Rat))
BDBM24185
PNG
((3-aminopropyl)(methyl)phosphinic acid | 3-Apmpa |...)
Show SMILES CP(O)(=O)CCCN
Show InChI InChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
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n/an/a 16n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-CGP-27,492 to gamma-aminobutyric acid type B receptor of rat cortex.


J Med Chem 38: 3313-31 (1995)


BindingDB Entry DOI: 10.7270/Q2HD7TPZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24183
PNG
(4-amino-n-[2,3-3H]butyric acid | 4-aminobutanoic a...)
Show SMILES NCCCC(O)=O
Show InChI InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
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n/an/a 17n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM24186
PNG
((3-amino-2-hydroxypropyl)phosphinic acid | 3-amino...)
Show SMILES NCC(=O)CP(O)O
Show InChI InChI=1S/C3H8NO3P/c4-1-3(5)2-8(6)7/h6-7H,1-2,4H2
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n/an/a 18n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM24183
PNG
(4-amino-n-[2,3-3H]butyric acid | 4-aminobutanoic a...)
Show SMILES NCCCC(O)=O
Show InChI InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
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n/an/a 25n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM24189
PNG
(3-aminopropylphosphinic derivative, (R)-4 | 3-amin...)
Show SMILES CP(O)(O)CC(=O)CN
Show InChI InChI=1S/C4H12NO3P/c1-9(7,8)3-4(6)2-5/h7-9H,2-3,5H2,1H3
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n/an/a 29n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to cat Gamma-aminobutyric acid type B receptor


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM50032964
PNG
((R)-4-Amino-3-(4-chloro-phenyl)-butyric acid | 4-A...)
Show SMILES NC[C@H](CC(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM24182
PNG
(4-amino-3-(4-chlorophenyl)butanoic acid | Baclofen...)
Show SMILES NCC(CC(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)
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n/an/a 35n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032958
PNG
(CHEMBL430501 | [3-Amino-2-(4-chloro-phenyl)-propyl...)
Show SMILES NCC(CP(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C9H13ClNO2P/c10-9-3-1-7(2-4-9)8(5-11)6-14(12)13/h1-4,8,14H,5-6,11H2,(H,12,13)
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n/an/a 39n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24189
PNG
(3-aminopropylphosphinic derivative, (R)-4 | 3-amin...)
Show SMILES CP(O)(O)CC(=O)CN
Show InChI InChI=1S/C4H12NO3P/c1-9(7,8)3-4(6)2-5/h7-9H,2-3,5H2,1H3
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n/an/a 45n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24189
PNG
(3-aminopropylphosphinic derivative, (R)-4 | 3-amin...)
Show SMILES CP(O)(O)CC(=O)CN
Show InChI InChI=1S/C4H12NO3P/c1-9(7,8)3-4(6)2-5/h7-9H,2-3,5H2,1H3
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n/an/a 45n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM50032969
PNG
(CHEMBL321255 | [3-Amino-2-(4-chloro-phenyl)-2-hydr...)
Show SMILES NCC(O)(CP(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C9H13ClNO3P/c10-8-3-1-7(2-4-8)9(12,5-11)6-15(13)14/h1-4,12,15H,5-6,11H2,(H,13,14)
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n/an/a 65n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM50032968
PNG
((3-Amino-propyl)-difluoromethyl-phosphinic acid | ...)
Show SMILES NCCCP(O)(=O)C(F)F
Show InChI InChI=1S/C4H10F2NO2P/c5-4(6)10(8,9)3-1-2-7/h4H,1-3,7H2,(H,8,9)
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n/an/a 89n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24182
PNG
(4-amino-3-(4-chlorophenyl)butanoic acid | Baclofen...)
Show SMILES NCC(CC(O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)
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n/an/a 107n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM50032971
PNG
((3-Amino-1-methyl-propyl)-methyl-phosphinic acid |...)
Show SMILES CC(CCN)P(C)(O)=O
Show InChI InChI=1S/C5H14NO2P/c1-5(3-4-6)9(2,7)8/h5H,3-4,6H2,1-2H3,(H,7,8)
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n/an/a 140n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM24189
PNG
(3-aminopropylphosphinic derivative, (R)-4 | 3-amin...)
Show SMILES CP(O)(O)CC(=O)CN
Show InChI InChI=1S/C4H12NO3P/c1-9(7,8)3-4(6)2-5/h7-9H,2-3,5H2,1H3
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n/an/a 152n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032971
PNG
((3-Amino-1-methyl-propyl)-methyl-phosphinic acid |...)
Show SMILES CC(CCN)P(C)(O)=O
Show InChI InChI=1S/C5H14NO2P/c1-5(3-4-6)9(2,7)8/h5H,3-4,6H2,1-2H3,(H,7,8)
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n/an/a 166n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to cat Gamma-aminobutyric acid type B receptor


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM50032961
PNG
((3-Amino-2-hydroxy-propyl)-difluoromethyl-phosphin...)
Show SMILES NCC(=O)CP(O)(O)C(F)F
Show InChI InChI=1S/C4H10F2NO3P/c5-4(6)11(9,10)2-3(8)1-7/h4,9-11H,1-2,7H2
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n/an/a 213n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032962
PNG
(((Z)-3-Amino-propenyl)-phosphinic acid | CGP38593 ...)
Show SMILES NCCCP(=O)=O
Show InChI InChI=1S/C3H8NO2P/c4-2-1-3-7(5)6/h1-4H2
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n/an/a 280n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032959
PNG
(CHEMBL111378 | [3-Amino-2-(4-fluoro-phenyl)-propyl...)
Show SMILES NCC(CP(O)=O)c1ccc(F)cc1
Show InChI InChI=1S/C9H13FNO2P/c10-9-3-1-7(2-4-9)8(5-11)6-14(12)13/h1-4,8,14H,5-6,11H2,(H,12,13)
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n/an/a 360n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032970
PNG
((3-Amino-butyl)-phosphinic acid | CHEMBL113907)
Show SMILES CC(N)CCP(O)=O
Show InChI InChI=1S/C4H12NO2P/c1-4(5)2-3-8(6)7/h4,8H,2-3,5H2,1H3,(H,6,7)
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n/an/a 500n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Rattus norvegicus (Rat))
BDBM50032973
PNG
(((Z)-3-Amino-propenyl)-methyl-phosphinic acid | 3-...)
Show SMILES CP(O)(=O)CCC=N
Show InChI InChI=1S/C4H10NO2P/c1-8(6,7)4-2-3-5/h3,5H,2,4H2,1H3,(H,6,7)
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n/an/a 665n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGP-27,492 binding to Gamma-aminobutyric acid type B receptor of rat cortex


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032975
PNG
((3-Amino-2-methyl-propyl)-phosphinic acid | CHEMBL...)
Show SMILES CC(CN)CP(O)=O
Show InChI InChI=1S/C4H12NO2P/c1-4(2-5)3-8(6)7/h4,8H,2-3,5H2,1H3,(H,6,7)
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n/an/a 780n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032977
PNG
((3-Amino-2-phenyl-propyl)-phosphinic acid | CHEMBL...)
Show SMILES NCC(CP(O)=O)c1ccccc1
Show InChI InChI=1S/C9H14NO2P/c10-6-9(7-13(11)12)8-4-2-1-3-5-8/h1-5,9,13H,6-7,10H2,(H,11,12)
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n/an/a 880n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid type B receptor subunit 1/2


(Homo sapiens (Human))
BDBM50032967
PNG
((3-Amino-1-methyl-propyl)-phosphinic acid | CHEMBL...)
Show SMILES CC(CCN)P(O)=O
Show InChI InChI=1S/C4H12NO2P/c1-4(2-3-5)8(6)7/h4,8H,2-3,5H2,1H3,(H,6,7)
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n/an/a 920n/an/an/an/an/an/a



CIBA-GEIGY AG

Curated by ChEMBL


Assay Description
Inhibition of [3H]-baclofen binding to Gamma-aminobutyric acid type B receptor of cat cerebellum


J Med Chem 38: 3297-312 (1995)


BindingDB Entry DOI: 10.7270/Q2N58KDP
More data for this
Ligand-Target Pair
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