Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50162199   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
GABA-A receptor; alpha-5/beta-3/gamma-2 (Homo sapiens (Human))	BDBM50162199 (9-[3-(2-methoxyethoxy)-2-pyridyloxy]-6-phenyl-4,5,...) Show SMILES COCCOc1cccnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-4.43,-7.89,;-4.4,-6.35,;-3.07,-5.58,;-3.07,-4.04,;-1.72,-3.29,;-.4,-4.06,;-.4,-5.58,;.93,-6.35,;2.27,-5.58,;2.25,-4.06,;.93,-3.3,;.93,-1.77,;-.4,-1,;-.4,.54,;.92,1.3,;.92,2.85,;2.08,3.91,;1.45,5.27,;-.07,5.13,;-.4,3.62,;-1.72,2.84,;-3.07,3.54,;-2.43,2.08,;-4.01,2.08,;-3.06,.53,;-4.38,1.3,;-4.38,2.84,;-1.72,1.3,;3.6,3.61,;4.09,2.17,;5.6,1.86,;6.61,3.01,;6.12,4.47,;4.6,4.78,)| Show InChI InChI=1S/C26H27N5O3/c1-32-14-15-33-21-8-5-13-27-20(21)16-34-26-23-18-11-9-17(10-12-18)22(23)25-29-28-24(31(25)30-26)19-6-3-2-4-7-19/h2-8,13,17-18H,9-12,14-16H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha5-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-3/beta-3/gamma-2 (Homo sapiens (Human))	BDBM50162199 (9-[3-(2-methoxyethoxy)-2-pyridyloxy]-6-phenyl-4,5,...) Show SMILES COCCOc1cccnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-4.43,-7.89,;-4.4,-6.35,;-3.07,-5.58,;-3.07,-4.04,;-1.72,-3.29,;-.4,-4.06,;-.4,-5.58,;.93,-6.35,;2.27,-5.58,;2.25,-4.06,;.93,-3.3,;.93,-1.77,;-.4,-1,;-.4,.54,;.92,1.3,;.92,2.85,;2.08,3.91,;1.45,5.27,;-.07,5.13,;-.4,3.62,;-1.72,2.84,;-3.07,3.54,;-2.43,2.08,;-4.01,2.08,;-3.06,.53,;-4.38,1.3,;-4.38,2.84,;-1.72,1.3,;3.6,3.61,;4.09,2.17,;5.6,1.86,;6.61,3.01,;6.12,4.47,;4.6,4.78,)| Show InChI InChI=1S/C26H27N5O3/c1-32-14-15-33-21-8-5-13-27-20(21)16-34-26-23-18-11-9-17(10-12-18)22(23)25-29-28-24(31(25)30-26)19-6-3-2-4-7-19/h2-8,13,17-18H,9-12,14-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha3-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair
GABA-A receptor; alpha-2/beta-3/gamma-2 (Homo sapiens (Human))	BDBM50162199 (9-[3-(2-methoxyethoxy)-2-pyridyloxy]-6-phenyl-4,5,...) Show SMILES COCCOc1cccnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-4.43,-7.89,;-4.4,-6.35,;-3.07,-5.58,;-3.07,-4.04,;-1.72,-3.29,;-.4,-4.06,;-.4,-5.58,;.93,-6.35,;2.27,-5.58,;2.25,-4.06,;.93,-3.3,;.93,-1.77,;-.4,-1,;-.4,.54,;.92,1.3,;.92,2.85,;2.08,3.91,;1.45,5.27,;-.07,5.13,;-.4,3.62,;-1.72,2.84,;-3.07,3.54,;-2.43,2.08,;-4.01,2.08,;-3.06,.53,;-4.38,1.3,;-4.38,2.84,;-1.72,1.3,;3.6,3.61,;4.09,2.17,;5.6,1.86,;6.61,3.01,;6.12,4.47,;4.6,4.78,)| Show InChI InChI=1S/C26H27N5O3/c1-32-14-15-33-21-8-5-13-27-20(21)16-34-26-23-18-11-9-17(10-12-18)22(23)25-29-28-24(31(25)30-26)19-6-3-2-4-7-19/h2-8,13,17-18H,9-12,14-16H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric acid A receptor alpha2-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-3/gamma-2 (Homo sapiens (Human))	BDBM50162199 (9-[3-(2-methoxyethoxy)-2-pyridyloxy]-6-phenyl-4,5,...) Show SMILES COCCOc1cccnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-4.43,-7.89,;-4.4,-6.35,;-3.07,-5.58,;-3.07,-4.04,;-1.72,-3.29,;-.4,-4.06,;-.4,-5.58,;.93,-6.35,;2.27,-5.58,;2.25,-4.06,;.93,-3.3,;.93,-1.77,;-.4,-1,;-.4,.54,;.92,1.3,;.92,2.85,;2.08,3.91,;1.45,5.27,;-.07,5.13,;-.4,3.62,;-1.72,2.84,;-3.07,3.54,;-2.43,2.08,;-4.01,2.08,;-3.06,.53,;-4.38,1.3,;-4.38,2.84,;-1.72,1.3,;3.6,3.61,;4.09,2.17,;5.6,1.86,;6.61,3.01,;6.12,4.47,;4.6,4.78,)| Show InChI InChI=1S/C26H27N5O3/c1-32-14-15-33-21-8-5-13-27-20(21)16-34-26-23-18-11-9-17(10-12-18)22(23)25-29-28-24(31(25)30-26)19-6-3-2-4-7-19/h2-8,13,17-18H,9-12,14-16H2,1H3	GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha1-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair