Compile Data Set for Download or QSAR

Found 10 hits with Last Name = 'dreyer' and Initial = 'gb'   

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
3-hydroxy-3-methylglutaryl-coenzyme A reductase (Homo sapiens (Human))	BDBM50279858 ((3R,5R)-7-(2-Benzyloxy-4,6-dichloro-phenyl)-3,5-di...) Show SMILES O[C@H](CCc1c(Cl)cc(Cl)cc1OCc1ccccc1)C[C@@H](O)CC(O)=O Show InChI InChI=1S/C20H22Cl2O5/c21-14-8-18(22)17(7-6-15(23)10-16(24)11-20(25)26)19(9-14)27-12-13-4-2-1-3-5-13/h1-5,8-9,15-16,23-24H,6-7,10-12H2,(H,25,26)/t15-,16-/m1/s1	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description The inhibitory activity of the compound against purified recombinant human HMG-CoA reductase was evaluated				Bioorg Med Chem Lett 1: 151-154 (1991) Article DOI: 10.1016/S0960-894X(01)80788-5 BindingDB Entry DOI: 10.7270/Q21836DP
					More data for this Ligand-Target Pair
3-hydroxy-3-methylglutaryl-coenzyme A reductase (Homo sapiens (Human))	BDBM50279859 ((S)-4-{[2-(2-Benzyloxy-4,6-dichloro-phenyl)-ethyl]...) Show SMILES OC(=O)CC(=O)CP(O)(O)CCc1c(Cl)cc(Cl)cc1OCc1ccccc1 Show InChI InChI=1S/C19H21Cl2O6P/c20-14-8-17(21)16(6-7-28(25,26)12-15(22)10-19(23)24)18(9-14)27-11-13-4-2-1-3-5-13/h1-5,8-9,25-26,28H,6-7,10-12H2,(H,23,24)	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description The inhibitory activity of the compound against purified recombinant human HMG-CoA reductase was evaluated				Bioorg Med Chem Lett 1: 151-154 (1991) Article DOI: 10.1016/S0960-894X(01)80788-5 BindingDB Entry DOI: 10.7270/Q21836DP
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281205 ((3R,5R)-3,5-Dibenzyl-3,4,5-trihydroxy-cyclohexanon...) Show SMILES OC1[C@@](O)(Cc2ccccc2)CC(=O)C[C@]1(O)Cc1ccccc1 Show InChI InChI=1S/C20H22O4/c21-17-13-19(23,11-15-7-3-1-4-8-15)18(22)20(24,14-17)12-16-9-5-2-6-10-16/h1-10,18,22-24H,11-14H2/t19-,20-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281202 ((3S,5S)-3,5-Dibenzyl-3,5-bis-hydroxymethyl-1-oxo-t...) Show SMILES OC[C@]1(Cc2ccccc2)C[S+]([O-])C[C@](CO)(Cc2ccccc2)C1O |r,wU:2.2,14.15,wD:14.17,2.1,(4.21,-7.86,;5.54,-7.08,;6.87,-7.85,;6.89,-9.39,;5.81,-10.49,;6.22,-11.96,;5.14,-13.06,;3.63,-12.69,;3.22,-11.2,;4.3,-10.1,;6.87,-6.31,;8.2,-5.56,;8.19,-4,;9.53,-6.3,;9.53,-7.84,;10.31,-9.17,;9.55,-10.51,;10.86,-7.07,;12.19,-7.84,;12.18,-9.39,;13.51,-10.16,;14.84,-9.39,;14.85,-7.85,;13.52,-7.08,;8.21,-8.62,;8.21,-10.16,)| Show InChI InChI=1S/C21H26O4S/c22-13-20(11-17-7-3-1-4-8-17)15-26(25)16-21(14-23,19(20)24)12-18-9-5-2-6-10-18/h1-10,19,22-24H,11-16H2/t19?,20-,21-,26?/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281202 ((3S,5S)-3,5-Dibenzyl-3,5-bis-hydroxymethyl-1-oxo-t...) Show SMILES OC[C@]1(Cc2ccccc2)C[S+]([O-])C[C@](CO)(Cc2ccccc2)C1O |r,wU:2.2,14.15,wD:14.17,2.1,(4.21,-7.86,;5.54,-7.08,;6.87,-7.85,;6.89,-9.39,;5.81,-10.49,;6.22,-11.96,;5.14,-13.06,;3.63,-12.69,;3.22,-11.2,;4.3,-10.1,;6.87,-6.31,;8.2,-5.56,;8.19,-4,;9.53,-6.3,;9.53,-7.84,;10.31,-9.17,;9.55,-10.51,;10.86,-7.07,;12.19,-7.84,;12.18,-9.39,;13.51,-10.16,;14.84,-9.39,;14.85,-7.85,;13.52,-7.08,;8.21,-8.62,;8.21,-10.16,)| Show InChI InChI=1S/C21H26O4S/c22-13-20(11-17-7-3-1-4-8-17)15-26(25)16-21(14-23,19(20)24)12-18-9-5-2-6-10-18/h1-10,19,22-24H,11-16H2/t19?,20-,21-,26?/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281207 ((2S,6S)-2,6-Dibenzyl-2,6-bis-hydroxymethyl-cyclohe...) Show SMILES OC[C@]1(Cc2ccccc2)C[C@H](O)C[C@](CO)(Cc2ccccc2)[C@H]1O |wU:2.2,14.15,24.27,wD:14.17,2.1,11.12,(15.23,-12.28,;13.9,-13.04,;12.57,-12.28,;12.56,-10.74,;13.64,-9.64,;13.23,-8.15,;14.32,-7.05,;15.82,-7.45,;16.23,-8.94,;15.14,-10.04,;12.57,-13.81,;11.24,-14.58,;11.24,-16.12,;9.91,-13.81,;9.91,-12.28,;9.14,-10.94,;9.9,-9.59,;8.58,-13.04,;7.25,-12.25,;7.26,-10.71,;5.93,-9.94,;4.6,-10.69,;4.59,-12.24,;5.92,-13.01,;11.24,-11.5,;11.24,-9.96,)| Show InChI InChI=1S/C22H28O4/c23-15-21(11-17-7-3-1-4-8-17)13-19(25)14-22(16-24,20(21)26)12-18-9-5-2-6-10-18/h1-10,19-20,23-26H,11-16H2/t19-,20-,21-,22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281204 ((3S,5S)-3,5-Dibenzyl-4-hydroxy-3,5-bis-hydroxymeth...) Show SMILES OC[C@]1(Cc2ccccc2)CC(=O)C[C@](CO)(Cc2ccccc2)C1O Show InChI InChI=1S/C22H26O4/c23-15-21(11-17-7-3-1-4-8-17)13-19(25)14-22(16-24,20(21)26)12-18-9-5-2-6-10-18/h1-10,20,23-24,26H,11-16H2/t21-,22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281206 ((2S,6S)-2,6-Dibenzyl-2,6-bis-hydroxymethyl-cyclohe...) Show SMILES OC[C@]1(Cc2ccccc2)C[C@H](O)C[C@](CO)(Cc2ccccc2)[C@@H]1O |wU:14.17,2.1,24.27,11.12,wD:2.2,14.15,(9.9,-9.59,;9.14,-10.94,;9.91,-12.28,;8.58,-13.04,;7.25,-12.25,;7.26,-10.71,;5.93,-9.94,;4.6,-10.69,;4.59,-12.24,;5.92,-13.01,;9.91,-13.81,;11.24,-14.58,;11.24,-16.12,;12.57,-13.81,;12.57,-12.28,;13.9,-13.04,;15.23,-12.28,;12.56,-10.74,;13.64,-9.64,;13.23,-8.15,;14.32,-7.05,;15.82,-7.45,;16.23,-8.94,;15.14,-10.04,;11.24,-11.5,;11.24,-9.96,)| Show InChI InChI=1S/C22H28O4/c23-15-21(11-17-7-3-1-4-8-17)13-19(25)14-22(16-24,20(21)26)12-18-9-5-2-6-10-18/h1-10,19-20,23-26H,11-16H2/t19-,20+,21-,22-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	8.30E+5	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281203 ((2S,6S)-2,6-Dibenzyl-cyclohexane-1,4-diol | CHEMBL...) Show SMILES O[C@H]1C[C@H](Cc2ccccc2)[C@H](O)[C@@H](Cc2ccccc2)C1 |wU:3.3,11.12,wD:13.14,1.0,(11.67,-10.37,;11.67,-8.83,;13,-8.06,;13,-6.53,;13,-4.99,;14.08,-3.9,;13.67,-2.41,;14.75,-1.31,;16.26,-1.7,;16.67,-3.2,;15.57,-4.29,;11.67,-5.75,;11.67,-4.21,;10.34,-6.53,;9.01,-7.29,;7.68,-6.52,;7.68,-4.97,;6.37,-4.18,;5.02,-4.95,;5.02,-6.49,;6.35,-7.26,;10.34,-8.06,)| Show InChI InChI=1S/C20H24O2/c21-19-13-17(11-15-7-3-1-4-8-15)20(22)18(14-19)12-16-9-5-2-6-10-16/h1-10,17-22H,11-14H2/t17-,18-,19-,20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	>2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM50281208 ((1S,3S)-1,3-Dibenzyl-cyclohexane-1,2,3-triol | CHE...) Show SMILES OC1[C@@](O)(Cc2ccccc2)CCC[C@]1(O)Cc1ccccc1 Show InChI InChI=1S/C20H24O3/c21-18-19(22,14-16-8-3-1-4-9-16)12-7-13-20(18,23)15-17-10-5-2-6-11-17/h1-6,8-11,18,21-23H,7,12-15H2/t19-,20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	>2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of recombinant HIV-1 protease at 37 degrees C and pH of 6.				Bioorg Med Chem Lett 3: 2717-2722 (1993) Article DOI: 10.1016/S0960-894X(01)80749-6 BindingDB Entry DOI: 10.7270/Q2ZP4623
					More data for this Ligand-Target Pair