Compile Data Set for Download or QSAR

Found 29 hits of ic50 for UniProtKB: P62813   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482687 (CHEMBL426916) Show SMILES Clc1ccc(N\C=C(/C(=O)NC2CCC2)C(=O)c2ccccc2Cl)cc1 Show InChI InChI=1S/C20H18Cl2N2O2/c21-13-8-10-14(11-9-13)23-12-17(20(26)24-15-4-3-5-15)19(25)16-6-1-2-7-18(16)22/h1-2,6-12,15,23H,3-5H2,(H,24,26)/b17-12-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482692 (CHEMBL390326) Show SMILES CCC(C)NC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C20H20Cl2N2O2/c1-3-13(2)24-20(26)17(12-23-15-10-8-14(21)9-11-15)19(25)16-6-4-5-7-18(16)22/h4-13,23H,3H2,1-2H3,(H,24,26)/b17-12-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238234 (US9388210, 14a | US9388210, 6a) Show SMILES [H][C@@]12CC\C(=C\C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8-/t14-,15+,16-,17-,19+,20-,21+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238243 (US9388210, 16a) Show SMILES [H][C@@]12CC\C(=C\C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)[C@H](C[C@]12C)OC Show InChI InChI=1S/C22H31NO3/c1-21-11-18(25)20-15(16(21)7-5-13(21)8-9-23)6-4-14-10-17(24)19(26-3)12-22(14,20)2/h8,14-17,19-20,24H,4-7,10-12H2,1-3H3/b13-8-/t14-,15-,16-,17-,19-,20+,21+,22-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	28	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482694 (CHEMBL229535) Show SMILES Clc1ccc(N\C=C(/C(=O)NC2CC2)C(=O)c2ccccc2Cl)cc1 Show InChI InChI=1S/C19H16Cl2N2O2/c20-12-5-7-13(8-6-12)22-11-16(19(25)23-14-9-10-14)18(24)15-3-1-2-4-17(15)21/h1-8,11,14,22H,9-10H2,(H,23,25)/b16-11-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482688 (CHEMBL387958) Show SMILES Clc1ccc(N\C=C(/C(=O)NC2CCCC2)C(=O)c2ccccc2Cl)cc1 Show InChI InChI=1S/C21H20Cl2N2O2/c22-14-9-11-15(12-10-14)24-13-18(21(27)25-16-5-1-2-6-16)20(26)17-7-3-4-8-19(17)23/h3-4,7-13,16,24H,1-2,5-6H2,(H,25,27)/b18-13-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50215531 (2-chloro-alpha-[[(4-chlorophenyl)amino]methylene]-...) Show SMILES CC(C)NC(=O)C(C=Nc1ccc(Cl)cc1)C(=O)c1ccccc1Cl |w:7.6| Show InChI InChI=1S/C19H18Cl2N2O2/c1-12(2)23-19(25)16(11-22-14-9-7-13(20)8-10-14)18(24)15-5-3-4-6-17(15)21/h3-12,16H,1-2H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482691 (CHEMBL556727) Show SMILES CCCNC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C19H18Cl2N2O2/c1-2-11-22-19(25)16(12-23-14-9-7-13(20)8-10-14)18(24)15-5-3-4-6-17(15)21/h3-10,12,23H,2,11H2,1H3,(H,22,25)/b16-12-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482690 (CHEMBL229374) Show SMILES CCNC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C18H16Cl2N2O2/c1-2-21-18(24)15(11-22-13-9-7-12(19)8-10-13)17(23)14-5-3-4-6-16(14)20/h3-11,22H,2H2,1H3,(H,21,24)/b15-11-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238245 (US9388210, 17a) Show SMILES [H][C@@]12CC\C(=C\C#N)[C@@]1(C)C[C@H](OC)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C22H33NO2/c1-21-10-8-16(24)12-15(21)4-6-17-18-7-5-14(9-11-23)22(18,2)13-19(25-3)20(17)21/h9,15-20,24H,4-8,10,12-13H2,1-3H3/b14-9-/t15-,16+,17-,18-,19-,20+,21-,22+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	53	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238238 (US9388210, 13a | US9388210, 15a) Show SMILES [H][C@@]12CC\C(=C\C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8-/t14-,15-,16+,17+,19-,20+,21-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	56	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482696 (CHEMBL229201) Show SMILES CCC(CC)NC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C21H22Cl2N2O2/c1-3-15(4-2)25-21(27)18(13-24-16-11-9-14(22)10-12-16)20(26)17-7-5-6-8-19(17)23/h5-13,15,24H,3-4H2,1-2H3,(H,25,27)/b18-13-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238234 (US9388210, 14a | US9388210, 6a) Show SMILES [H][C@@]12CC\C(=C\C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8-/t14-,15+,16-,17-,19+,20-,21+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	128	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482686 (CHEMBL227018) Show SMILES CNC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C17H14Cl2N2O2/c1-20-17(23)14(10-21-12-8-6-11(18)7-9-12)16(22)13-4-2-3-5-15(13)19/h2-10,21H,1H3,(H,20,23)/b14-10-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482689 (CHEMBL388639) Show SMILES CC(C)C(C)NC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C21H22Cl2N2O2/c1-13(2)14(3)25-21(27)18(12-24-16-10-8-15(22)9-11-16)20(26)17-6-4-5-7-19(17)23/h4-14,24H,1-3H3,(H,25,27)/b18-12-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238238 (US9388210, 13a | US9388210, 15a) Show SMILES [H][C@@]12CC\C(=C\C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8-/t14-,15-,16+,17+,19-,20+,21-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	474	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238235 (US9388210, 14b | US9388210, 6b) Show SMILES [H][C@@]12CC\C(=C/C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8+/t14-,15+,16-,17-,19+,20-,21+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	501	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238244 (US9388210, 16b) Show SMILES [H][C@@]12CC\C(=C/C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)[C@H](C[C@]12C)OC Show InChI InChI=1S/C22H31NO3/c1-21-11-18(25)20-15(16(21)7-5-13(21)8-9-23)6-4-14-10-17(24)19(26-3)12-22(14,20)2/h8,14-17,19-20,24H,4-7,10-12H2,1-3H3/b13-8+/t14-,15-,16-,17-,19-,20+,21+,22-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	544	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238246 (US9388210, 17b) Show SMILES [H][C@@]12CC\C(=C/C#N)[C@@]1(C)C[C@H](OC)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C22H33NO2/c1-21-10-8-16(24)12-15(21)4-6-17-18-7-5-14(9-11-23)22(18,2)13-19(25-3)20(17)21/h9,15-20,24H,4-8,10,12-13H2,1-3H3/b14-9+/t15-,16+,17-,18-,19-,20+,21-,22+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	605	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238236 (US9388210, 6c) Show SMILES [H][C@@]12CC\C(=C(/C)C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C22H31NO2/c1-13(12-23)17-6-7-18-16-5-4-14-10-15(24)8-9-21(14,2)20(16)19(25)11-22(17,18)3/h14-16,18,20,24H,4-11H2,1-3H3/b17-13-/t14-,15+,16-,18-,20+,21-,22+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	629	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238248 (US9388210, 5b) Show SMILES [H][C@@]12CC[C@H](C=O)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C20H30O3/c1-19-8-7-14(22)9-12(19)3-5-15-16-6-4-13(11-21)20(16,2)10-17(23)18(15)19/h11-16,18,22H,3-10H2,1-2H3/t12-,13+,14+,15-,16-,18+,19-,20+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	770	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238247 (US9388210, 5a) Show SMILES [H][C@@]12CC=C(C=O)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C |t:3| Show InChI InChI=1S/C20H28O3/c1-19-8-7-14(22)9-12(19)3-5-15-16-6-4-13(11-21)20(16,2)10-17(23)18(15)19/h4,11-12,14-16,18,22H,3,5-10H2,1-2H3/t12-,14+,15-,16-,18+,19-,20+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	997	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238249 (US9388210, 5c) Show SMILES [H][C@@]12CC[C@H](CC#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H31NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h13-17,19,23H,3-9,11-12H2,1-2H3/t13-,14+,15-,16+,17+,19-,20+,21-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238239 (US9388210, 13b | US9388210, 15b) Show SMILES [H][C@@]12CC\C(=C/C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8+/t14-,15-,16+,17+,19-,20+,21-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482695 (CHEMBL227017) Show SMILES NC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C16H12Cl2N2O2/c17-10-5-7-11(8-6-10)20-9-13(16(19)22)15(21)12-3-1-2-4-14(12)18/h1-9,20H,(H2,19,22)/b13-9-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238237 (US9388210, 6d) Show SMILES C\C(C#N)=C1\CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C Show InChI InChI=1S/C22H31NO2/c1-13(12-23)17-6-7-18-16-5-4-14-10-15(24)8-9-21(14,2)20(16)19(25)11-22(17,18)3/h14-16,18,20,24H,4-11H2,1-3H3/b17-13+/t14-,15+,16-,18-,20+,21-,22+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.84E+3	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238235 (US9388210, 14b | US9388210, 6b) Show SMILES [H][C@@]12CC\C(=C/C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8+/t14-,15+,16-,17-,19+,20-,21+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.03E+3	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM50482693 (CHEMBL388638) Show SMILES CC(C)(C)NC(=O)C(=C/Nc1ccc(Cl)cc1)\C(=O)c1ccccc1Cl Show InChI InChI=1S/C20H20Cl2N2O2/c1-20(2,3)24-19(26)16(12-23-14-10-8-13(21)9-11-14)18(25)15-6-4-5-7-17(15)22/h4-12,23H,1-3H3,(H,24,26)/b16-12-	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of rat GABA alpha-1-beta-2-gamma-2 receptor				Eur J Med Chem 45: 3595-600 (2010) Article DOI: 10.1016/j.ejmech.2010.05.004 BindingDB Entry DOI: 10.7270/Q27D2XZD
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Rattus norvegicus (Rat))	BDBM238239 (US9388210, 13b | US9388210, 15b) Show SMILES [H][C@@]12CC\C(=C/C#N)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C Show InChI InChI=1S/C21H29NO2/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,14-17,19,23H,3-7,9,11-12H2,1-2H3/b13-8+/t14-,15-,16+,17+,19-,20+,21-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	7.4	25
WASHINGTON UNIVERSITY US Patent					Assay Description Briefly, aliquots of membrane solution (0.5 mg/mL final protein concentration in assay) were incubated with 5 μM GABA, 2 nM [35S]TBPS (45−...				US Patent US9388210 (2016) BindingDB Entry DOI: 10.7270/Q29K4949
					More data for this Ligand-Target Pair