Compile Data Set for Download or QSAR

Found 29 hits Enz. Inhib. hit(s) with all data for entry = 50048115   

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
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50348228 (CHEMBL1800807) Show SMILES COc1cc(F)c(cc1-c1ccc(cc1CN1[C@@H](C)[C@H](OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(C)C |r| Show InChI InChI=1S/C30H25F10NO3/c1-14(2)22-11-23(25(43-4)12-24(22)31)21-6-5-18(28(32,33)34)9-17(21)13-41-15(3)26(44-27(41)42)16-7-19(29(35,36)37)10-20(8-16)30(38,39)40/h5-12,14-15,26H,13H2,1-4H3/t15-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204929 (CHEMBL3955613) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CC(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C35H37F6N5O/c1-21(2)24-7-9-32(47-5)31(13-24)30-8-6-22(3)10-25(30)20-46(33-42-15-26(16-43-33)27-17-44-45(4)19-27)18-23-11-28(34(36,37)38)14-29(12-23)35(39,40)41/h7,9,11-17,19,21-22H,6,8,10,18,20H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204922 (CHEMBL3913485) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H39F6N5O/c1-22(2)24-7-8-32(48-6)31(13-24)30-9-10-34(3,4)15-25(30)21-47(33-43-16-26(17-44-33)27-18-45-46(5)20-27)19-23-11-28(35(37,38)39)14-29(12-23)36(40,41)42/h7-8,11-14,16-18,20,22H,9-10,15,19,21H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204924 (CHEMBL3946904) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CC(CC1)C(C)(C)C)C(C)C |c:9| Show InChI InChI=1S/C38H43F6N5O/c1-23(2)25-8-11-34(50-7)33(15-25)32-10-9-29(36(3,4)5)14-26(32)22-49(35-45-17-27(18-46-35)28-19-47-48(6)21-28)20-24-12-30(37(39,40)41)16-31(13-24)38(42,43)44/h8,11-13,15-19,21,23,29H,9-10,14,20,22H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204927 (CHEMBL3976202) Show SMILES CCC1CCC(=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)C1)c1cc(ccc1OC)C(C)C |t:5| Show InChI InChI=1S/C36H39F6N5O/c1-6-23-7-9-31(32-14-25(22(2)3)8-10-33(32)48-5)26(11-23)21-47(34-43-16-27(17-44-34)28-18-45-46(4)20-28)19-24-12-29(35(37,38)39)15-30(13-24)36(40,41)42/h8,10,12-18,20,22-23H,6-7,9,11,19,21H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204934 (CHEMBL3931395) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)N2CCC(N)CC2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C37H45F6N5O/c1-23(2)25-6-7-33(49-5)32(16-25)31-8-11-35(3,4)18-26(31)22-48(34-45-19-30(20-46-34)47-12-9-29(44)10-13-47)21-24-14-27(36(38,39)40)17-28(15-24)37(41,42)43/h6-7,14-17,19-20,23,29H,8-13,18,21-22,44H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204928 (CHEMBL3909889) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(OCCO)cn2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C34H39F6N3O3/c1-21(2)23-6-7-30(45-5)29(14-23)28-8-9-32(3,4)16-24(28)20-43(31-41-17-27(18-42-31)46-11-10-44)19-22-12-25(33(35,36)37)15-26(13-22)34(38,39)40/h6-7,12-15,17-18,21,44H,8-11,16,19-20H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204923 (CHEMBL3964613) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CCc2ccccc12)C(C)C |c:9| Show InChI InChI=1S/C38H35F6N5O/c1-23(2)26-11-12-34(50-4)33(15-26)35-27(10-9-25-7-5-6-8-32(25)35)22-49(36-45-17-28(18-46-36)29-19-47-48(3)21-29)20-24-13-30(37(39,40)41)16-31(14-24)38(42,43)44/h5-8,11-19,21,23H,9-10,20,22H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204919 (CHEMBL3958109) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(OCCCC(O)=O)cn2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H41F6N3O4/c1-22(2)24-8-9-31(48-5)30(15-24)29-10-11-34(3,4)17-25(29)21-45(33-43-18-28(19-44-33)49-12-6-7-32(46)47)20-23-13-26(35(37,38)39)16-27(14-23)36(40,41)42/h8-9,13-16,18-19,22H,6-7,10-12,17,20-21H2,1-5H3,(H,46,47)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204917 (CHEMBL3922480) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)N2CCNCC2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H43F6N5O/c1-23(2)25-6-7-32(48-5)31(16-25)30-8-9-34(3,4)18-26(30)22-47(33-44-19-29(20-45-33)46-12-10-43-11-13-46)21-24-14-27(35(37,38)39)17-28(15-24)36(40,41)42/h6-7,14-17,19-20,23,43H,8-13,18,21-22H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204940 (CHEMBL3918826) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(OCC(O)=O)cn2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C34H37F6N3O4/c1-20(2)22-6-7-29(46-5)28(12-22)27-8-9-32(3,4)14-23(27)18-43(31-41-15-26(16-42-31)47-19-30(44)45)17-21-10-24(33(35,36)37)13-25(11-21)34(38,39)40/h6-7,10-13,15-16,20H,8-9,14,17-19H2,1-5H3,(H,44,45)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204932 (CHEMBL3904480) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)N2CCC(CC2)C(O)=O)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C38H44F6N4O3/c1-23(2)26-6-7-33(51-5)32(16-26)31-8-11-36(3,4)18-27(31)22-48(21-24-14-28(37(39,40)41)17-29(15-24)38(42,43)44)35-45-19-30(20-46-35)47-12-9-25(10-13-47)34(49)50/h6-7,14-17,19-20,23,25H,8-13,18,21-22H2,1-5H3,(H,49,50)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204942 (CHEMBL3963665) Show SMILES COCCOc1cnc(nc1)N(CC1=C(CCC(C)(C)C1)c1cc(ccc1OC)C(C)C)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F |t:14| Show InChI InChI=1S/C35H41F6N3O3/c1-22(2)24-7-8-31(46-6)30(15-24)29-9-10-33(3,4)17-25(29)21-44(32-42-18-28(19-43-32)47-12-11-45-5)20-23-13-26(34(36,37)38)16-27(14-23)35(39,40)41/h7-8,13-16,18-19,22H,9-12,17,20-21H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204933 (CHEMBL3907440) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)N2CCC(CC2)NC(C)=O)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C39H47F6N5O2/c1-24(2)27-7-8-35(52-6)34(17-27)33-9-12-37(4,5)19-28(33)23-50(22-26-15-29(38(40,41)42)18-30(16-26)39(43,44)45)36-46-20-32(21-47-36)49-13-10-31(11-14-49)48-25(3)51/h7-8,15-18,20-21,24,31H,9-14,19,22-23H2,1-6H3,(H,48,51)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204939 (CHEMBL3941452) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)N2CCOCC2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H42F6N4O2/c1-23(2)25-6-7-32(47-5)31(16-25)30-8-9-34(3,4)18-26(30)22-46(33-43-19-29(20-44-33)45-10-12-48-13-11-45)21-24-14-27(35(37,38)39)17-28(15-24)36(40,41)42/h6-7,14-17,19-20,23H,8-13,18,21-22H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	860	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204946 (CHEMBL3890759) Show SMILES COC(=O)COc1cnc(nc1)N(CC1=C(CCC(C)(C)C1)c1cc(ccc1OC)C(C)C)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F |t:15| Show InChI InChI=1S/C35H39F6N3O4/c1-21(2)23-7-8-30(46-5)29(13-23)28-9-10-33(3,4)15-24(28)19-44(32-42-16-27(17-43-32)48-20-31(45)47-6)18-22-11-25(34(36,37)38)14-26(12-22)35(39,40)41/h7-8,11-14,16-17,21H,9-10,15,18-20H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204945 (CHEMBL3903893) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CCCC1)C(C)C |c:9| Show InChI InChI=1S/C34H35F6N5O/c1-21(2)23-9-10-31(46-4)30(13-23)29-8-6-5-7-24(29)20-45(32-41-15-25(16-42-32)26-17-43-44(3)19-26)18-22-11-27(33(35,36)37)14-28(12-22)34(38,39)40/h9-17,19,21H,5-8,18,20H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204926 (CHEMBL3984241) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CCCCC1)C(C)C |c:9| Show InChI InChI=1S/C35H37F6N5O/c1-22(2)24-10-11-32(47-4)31(14-24)30-9-7-5-6-8-25(30)21-46(33-42-16-26(17-43-33)27-18-44-45(3)20-27)19-23-12-28(34(36,37)38)15-29(13-23)35(39,40)41/h10-18,20,22H,5-9,19,21H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204918 (CHEMBL3958905) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)N2CCN(C)CC2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C37H45F6N5O/c1-24(2)26-7-8-33(49-6)32(17-26)31-9-10-35(3,4)19-27(31)23-48(34-44-20-30(21-45-34)47-13-11-46(5)12-14-47)22-25-15-28(36(38,39)40)18-29(16-25)37(41,42)43/h7-8,15-18,20-21,24H,9-14,19,22-23H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204920 (CHEMBL3960862) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)CCC1)C(C)C |c:9| Show InChI InChI=1S/C33H33F6N5O/c1-20(2)22-8-9-30(45-4)29(12-22)28-7-5-6-23(28)19-44(31-40-14-24(15-41-31)25-16-42-43(3)18-25)17-21-10-26(32(34,35)36)13-27(11-21)33(37,38)39/h8-16,18,20H,5-7,17,19H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204944 (CHEMBL3927748) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(O)cn2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C32H35F6N3O2/c1-19(2)21-6-7-28(43-5)27(12-21)26-8-9-30(3,4)14-22(26)18-41(29-39-15-25(42)16-40-29)17-20-10-23(31(33,34)35)13-24(11-20)32(36,37)38/h6-7,10-13,15-16,19,42H,8-9,14,17-18H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.52E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204921 (CHEMBL3975244) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cnn(C)c2)c2ccccc2CC1)C(C)C |c:9| Show InChI InChI=1S/C38H35F6N5O/c1-23(2)26-10-12-35(50-4)33(15-26)32-11-9-25-7-5-6-8-31(25)34(32)22-49(36-45-17-27(18-46-36)28-19-47-48(3)21-28)20-24-13-29(37(39,40)41)16-30(14-24)38(42,43)44/h5-8,10,12-19,21,23H,9,11,20,22H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204937 (CHEMBL3966113) Show SMILES COC(=O)N(CC1=C(CCC(C)(C)C1)c1cc(ccc1OC)C(C)C)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F |t:6| Show InChI InChI=1S/C30H35F6NO3/c1-18(2)20-7-8-26(39-5)25(13-20)24-9-10-28(3,4)15-21(24)17-37(27(38)40-6)16-19-11-22(29(31,32)33)14-23(12-19)30(34,35)36/h7-8,11-14,18H,9-10,15-17H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204941 (CHEMBL3962127) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(Br)cn2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C32H34BrF6N3O/c1-19(2)21-6-7-28(43-5)27(12-21)26-8-9-30(3,4)14-22(26)18-42(29-40-15-25(33)16-41-29)17-20-10-23(31(34,35)36)13-24(11-20)32(37,38)39/h6-7,10-13,15-16,19H,8-9,14,17-18H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204938 (CHEMBL3963680) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2cccs2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H37F6N3OS/c1-22(2)24-8-9-31(46-5)30(15-24)29-10-11-34(3,4)17-25(29)21-45(33-43-18-26(19-44-33)32-7-6-12-47-32)20-23-13-27(35(37,38)39)16-28(14-23)36(40,41)42/h6-9,12-16,18-19,22H,10-11,17,20-21H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204935 (CHEMBL3972579) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)OCC(C)C)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C33H41F6NO3/c1-20(2)19-43-30(41)40(17-22-12-25(32(34,35)36)15-26(13-22)33(37,38)39)18-24-16-31(5,6)11-10-27(24)28-14-23(21(3)4)8-9-29(28)42-7/h8-9,12-15,20-21H,10-11,16-19H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204931 (CHEMBL3901482) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)OCc2ccccc2)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H39F6NO3/c1-23(2)26-11-12-32(45-5)31(17-26)30-13-14-34(3,4)19-27(30)21-43(33(44)46-22-24-9-7-6-8-10-24)20-25-15-28(35(37,38)39)18-29(16-25)36(40,41)42/h6-12,15-18,23H,13-14,19-22H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204925 (CHEMBL3984332) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2ccnn2C)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C36H39F6N5O/c1-22(2)24-7-8-32(48-6)30(15-24)29-9-11-34(3,4)17-25(29)21-47(33-43-18-26(19-44-33)31-10-12-45-46(31)5)20-23-13-27(35(37,38)39)16-28(14-23)36(40,41)42/h7-8,10,12-16,18-19,22H,9,11,17,20-21H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM50204930 (CHEMBL3965575) Show SMILES COc1ccc(cc1C1=C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ncc(cn2)-c2c(C)noc2C)CC(C)(C)CC1)C(C)C |c:9| Show InChI InChI=1S/C37H40F6N4O2/c1-21(2)25-8-9-32(48-7)31(14-25)30-10-11-35(5,6)16-26(30)20-47(34-44-17-27(18-45-34)33-22(3)46-49-23(33)4)19-24-12-28(36(38,39)40)15-29(13-24)37(41,42)43/h8-9,12-15,17-18,21H,10-11,16,19-20H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of recombinant CETP (unknown origin) assessed as inhibition of BODIPY-labeled cholesteryl transfer to fluorescent substrate by fluorimetri...				Eur J Med Chem 123: 419-430 (2016) Article DOI: 10.1016/j.ejmech.2016.07.065 BindingDB Entry DOI: 10.7270/Q2QC05G8
					More data for this Ligand-Target Pair