Found 85 hits of Enzyme Inhibition Constant Data 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)) | BDBM50128175
(1,1,1-Trifluoro-3-{[3-(3-isopropyl-phenoxy)-phenyl...)Show SMILES CC(C)c1cccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C27H26F7NO3/c1-17(2)19-7-4-9-21(13-19)37-22-10-5-8-20(14-22)35(16-24(36)26(30,31)32)15-18-6-3-11-23(12-18)38-27(33,34)25(28)29/h3-14,17,24-25,36H,15-16H2,1-2H3 | 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 | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128164
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-chlo...)Show SMILES CCc1cc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)ccc1Cl Show InChI InChI=1S/C26H23ClF7NO3/c1-2-17-12-20(9-10-22(17)27)37-19-7-4-6-18(13-19)35(15-23(36)25(30,31)32)14-16-5-3-8-21(11-16)38-26(33,34)24(28)29/h3-13,23-24,36H,2,14-15H2,1H3 | 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 | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217136
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3-(2,2...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cccc(CC(F)(F)F)c2)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C26H21F10NO3/c27-23(28)26(35,36)40-21-9-2-5-17(11-21)14-37(15-22(38)25(32,33)34)18-6-3-8-20(12-18)39-19-7-1-4-16(10-19)13-24(29,30)31/h1-12,22-23,38H,13-15H2 | 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 | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128146
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3-ethy...)Show SMILES CCc1cccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C26H24F7NO3/c1-2-17-6-3-9-20(12-17)36-21-10-5-8-19(14-21)34(16-23(35)25(29,30)31)15-18-7-4-11-22(13-18)37-26(32,33)24(27)28/h3-14,23-24,35H,2,15-16H2,1H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217131
(3-((3-(2-(trifluoromethoxy)benzyloxy)phenyl)(3-(1,...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OCc2ccccc2OC(F)(F)F)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C26H21F10NO4/c27-23(28)25(32,33)40-20-9-3-5-16(11-20)13-37(14-22(38)24(29,30)31)18-7-4-8-19(12-18)39-15-17-6-1-2-10-21(17)41-26(34,35)36/h1-12,22-23,38H,13-15H2 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217123
(3-((3-(3,5-dimethylphenoxy)benzyl)(3-phenoxyphenyl...)Show SMILES Cc1cc(C)cc(Oc2cccc(CN(CC(O)C(F)(F)F)c3cccc(Oc4ccccc4)c3)c2)c1 |w:16.16| Show InChI InChI=1S/C30H28F3NO3/c1-21-14-22(2)16-28(15-21)37-26-12-6-8-23(17-26)19-34(20-29(35)30(31,32)33)24-9-7-13-27(18-24)36-25-10-4-3-5-11-25/h3-18,29,35H,19-20H2,1-2H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128185
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3-ethy...)Show SMILES CCc1cc(C)cc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C27H26F7NO3/c1-3-18-10-17(2)11-23(12-18)37-21-8-5-7-20(14-21)35(16-24(36)26(30,31)32)15-19-6-4-9-22(13-19)38-27(33,34)25(28)29/h4-14,24-25,36H,3,15-16H2,1-2H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128181
(1,1,1-Trifluoro-3-{[3-(4-propoxy-phenoxy)-phenyl]-...)Show SMILES CCCOc1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1 Show InChI InChI=1S/C27H26F7NO4/c1-2-13-37-20-9-11-21(12-10-20)38-22-7-4-6-19(15-22)35(17-24(36)26(30,31)32)16-18-5-3-8-23(14-18)39-27(33,34)25(28)29/h3-12,14-15,24-25,36H,2,13,16-17H2,1H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128167
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3,4-di...)Show SMILES Cc1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1C Show InChI InChI=1S/C26H24F7NO3/c1-16-9-10-21(11-17(16)2)36-20-7-4-6-19(13-20)34(15-23(35)25(29,30)31)14-18-5-3-8-22(12-18)37-26(32,33)24(27)28/h3-13,23-24,35H,14-15H2,1-2H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217129
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3,4-di...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(F)c(F)c2)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C24H18F9NO3/c25-19-8-7-17(11-20(19)26)36-16-5-2-4-15(10-16)34(13-21(35)23(29,30)31)12-14-3-1-6-18(9-14)37-24(32,33)22(27)28/h1-11,21-22,35H,12-13H2 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128169
(1,1,1-Trifluoro-3-{[3-(4-fluoro-3-methyl-phenoxy)-...)Show SMILES Cc1cc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)ccc1F Show InChI InChI=1S/C25H21F8NO3/c1-15-10-19(8-9-21(15)26)36-18-6-3-5-17(12-18)34(14-22(35)24(29,30)31)13-16-4-2-7-20(11-16)37-25(32,33)23(27)28/h2-12,22-23,35H,13-14H2,1H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217128
(3-((3-(2-(2,2,2-trifluoroethyl)benzyloxy)phenyl)(3...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OCc2ccccc2CC(F)(F)F)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C27H23F10NO3/c28-24(29)27(36,37)41-22-10-3-5-17(11-22)14-38(15-23(39)26(33,34)35)20-8-4-9-21(12-20)40-16-19-7-2-1-6-18(19)13-25(30,31)32/h1-12,23-24,39H,13-16H2 | 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 | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128166
(1,1,1-Trifluoro-3-{[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc3CCCCc3c2)c1)C(F)(F)F Show InChI InChI=1S/C28H26F7NO3/c29-26(30)28(34,35)39-24-10-3-5-18(13-24)16-36(17-25(37)27(31,32)33)21-8-4-9-22(15-21)38-23-12-11-19-6-1-2-7-20(19)14-23/h3-5,8-15,25-26,37H,1-2,6-7,16-17H2 | 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 | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128143
(1,1,1-Trifluoro-3-[[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES Cc1cccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C25H22F7NO3/c1-16-5-2-8-19(11-16)35-20-9-4-7-18(13-20)33(15-22(34)24(28,29)30)14-17-6-3-10-21(12-17)36-25(31,32)23(26)27/h2-13,22-23,34H,14-15H2,1H3 | 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 | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128152
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3-tert...)Show SMILES CC(C)(C)c1cccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C28H28F7NO3/c1-26(2,3)19-8-5-10-21(14-19)38-22-11-6-9-20(15-22)36(17-24(37)27(31,32)33)16-18-7-4-12-23(13-18)39-28(34,35)25(29)30/h4-15,24-25,37H,16-17H2,1-3H3 | 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 | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128162
(1,1,1-Trifluoro-3-{[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(cc2)C(F)(F)F)c1)C(F)(F)F Show InChI InChI=1S/C25H19F10NO3/c26-22(27)25(34,35)39-20-6-1-3-15(11-20)13-36(14-21(37)24(31,32)33)17-4-2-5-19(12-17)38-18-9-7-16(8-10-18)23(28,29)30/h1-12,21-22,37H,13-14H2 | 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 | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128148
(1,1,1-Trifluoro-3-{[3-(3-fluoro-2-nitro-phenoxy)-p...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cccc(F)c2[N+]([O-])=O)c1)C(F)(F)F Show InChI InChI=1S/C24H18F8N2O5/c25-18-8-3-9-19(21(18)34(36)37)38-16-6-2-5-15(11-16)33(13-20(35)23(28,29)30)12-14-4-1-7-17(10-14)39-24(31,32)22(26)27/h1-11,20,22,35H,12-13H2 | 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 | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128153
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(2,3-di...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cccc(F)c2F)c1)C(F)(F)F Show InChI InChI=1S/C24H18F9NO3/c25-18-8-3-9-19(21(18)26)36-16-6-2-5-15(11-16)34(13-20(35)23(29,30)31)12-14-4-1-7-17(10-14)37-24(32,33)22(27)28/h1-11,20,22,35H,12-13H2 | 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 | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128168
(1,1,1-Trifluoro-3-[[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES Cc1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1 Show InChI InChI=1S/C25H22F7NO3/c1-16-8-10-19(11-9-16)35-20-6-3-5-18(13-20)33(15-22(34)24(28,29)30)14-17-4-2-7-21(12-17)36-25(31,32)23(26)27/h2-13,22-23,34H,14-15H2,1H3 | 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 | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094513
(1,1,1-Trifluoro-3-{(3-phenoxy-phenyl)-[3-(1,1,2,2-...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C24H20F7NO3/c25-22(26)24(30,31)35-20-11-4-6-16(12-20)14-32(15-21(33)23(27,28)29)17-7-5-10-19(13-17)34-18-8-2-1-3-9-18/h1-13,21-22,33H,14-15H2 | 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 | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217130
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-buty...)Show SMILES CCCCc1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1 |w:17.18| Show InChI InChI=1S/C28H28F7NO3/c1-2-3-6-19-11-13-22(14-12-19)38-23-9-5-8-21(16-23)36(18-25(37)27(31,32)33)17-20-7-4-10-24(15-20)39-28(34,35)26(29)30/h4-5,7-16,25-26,37H,2-3,6,17-18H2,1H3 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128165
(1,1,1-Trifluoro-3-{[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cccc(c2)C(F)(F)F)c1)C(F)(F)F Show InChI InChI=1S/C25H19F10NO3/c26-22(27)25(34,35)39-20-9-1-4-15(10-20)13-36(14-21(37)24(31,32)33)17-6-3-8-19(12-17)38-18-7-2-5-16(11-18)23(28,29)30/h1-12,21-22,37H,13-14H2 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128173
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-chlo...)Show SMILES Cc1cc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)ccc1Cl Show InChI InChI=1S/C25H21ClF7NO3/c1-15-10-19(8-9-21(15)26)36-18-6-3-5-17(12-18)34(14-22(35)24(29,30)31)13-16-4-2-7-20(11-16)37-25(32,33)23(27)28/h2-12,22-23,35H,13-14H2,1H3 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128184
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3-(dim...)Show SMILES CN(C)c1cccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C26H25F7N2O3/c1-34(2)18-7-4-9-20(13-18)37-21-10-5-8-19(14-21)35(16-23(36)25(29,30)31)15-17-6-3-11-22(12-17)38-26(32,33)24(27)28/h3-14,23-24,36H,15-16H2,1-2H3 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128177
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(cycloh...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OCC2CCCCC2)c1)C(F)(F)F Show InChI InChI=1S/C25H28F7NO3/c26-23(27)25(31,32)36-21-11-4-8-18(12-21)14-33(15-22(34)24(28,29)30)19-9-5-10-20(13-19)35-16-17-6-2-1-3-7-17/h4-5,8-13,17,22-23,34H,1-3,6-7,14-16H2 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128132
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(3,5-di...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cc(F)cc(F)c2)c1)C(F)(F)F Show InChI InChI=1S/C24H18F9NO3/c25-15-8-16(26)10-20(9-15)36-18-5-2-4-17(11-18)34(13-21(35)23(29,30)31)12-14-3-1-6-19(7-14)37-24(32,33)22(27)28/h1-11,21-22,35H,12-13H2 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128138
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(benzyl...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OCc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C25H22F7NO3/c26-23(27)25(31,32)36-21-11-4-8-18(12-21)14-33(15-22(34)24(28,29)30)19-9-5-10-20(13-19)35-16-17-6-2-1-3-7-17/h1-13,22-23,34H,14-16H2 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128133
(1,1,1-Trifluoro-3-{[3-(4-isopropyl-3-methyl-phenox...)Show SMILES CC(C)c1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1C Show InChI InChI=1S/C28H28F7NO3/c1-17(2)24-11-10-22(12-18(24)3)38-21-8-5-7-20(14-21)36(16-25(37)27(31,32)33)15-19-6-4-9-23(13-19)39-28(34,35)26(29)30/h4-14,17,25-26,37H,15-16H2,1-3H3 | 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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128159
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(2-chlo...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccccc2Cl)c1)C(F)(F)F Show InChI InChI=1S/C24H19ClF7NO3/c25-19-9-1-2-10-20(19)35-17-7-4-6-16(12-17)33(14-21(34)23(28,29)30)13-15-5-3-8-18(11-15)36-24(31,32)22(26)27/h1-12,21-22,34H,13-14H2 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128145
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-chlo...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(Cl)cc2)c1)C(F)(F)F Show InChI InChI=1S/C24H19ClF7NO3/c25-16-7-9-18(10-8-16)35-19-5-2-4-17(12-19)33(14-21(34)23(28,29)30)13-15-3-1-6-20(11-15)36-24(31,32)22(26)27/h1-12,21-22,34H,13-14H2 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118037
(3-((3-cyclopentylbenzyl)(3-phenoxyphenyl)amino)-1,...)Show SMILES OC(CN(Cc1cccc(c1)C1CCCC1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C27H28F3NO2/c28-27(29,30)26(32)19-31(18-20-8-6-11-22(16-20)21-9-4-5-10-21)23-12-7-15-25(17-23)33-24-13-2-1-3-14-24/h1-3,6-8,11-17,21,26,32H,4-5,9-10,18-19H2 | 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 | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128176
(1,1,1-Trifluoro-3-{[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OCc2cccc(OC(F)(F)F)c2)c1)C(F)(F)F Show InChI InChI=1S/C26H21F10NO4/c27-23(28)25(32,33)40-20-8-1-4-16(10-20)13-37(14-22(38)24(29,30)31)18-6-3-7-19(12-18)39-15-17-5-2-9-21(11-17)41-26(34,35)36/h1-12,22-23,38H,13-15H2 | 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 | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128183
(1,1,1-Trifluoro-3-{(3-isopropoxy-phenyl)-[3-(1,1,2...)Show SMILES CC(C)Oc1cccc(c1)N(CC(O)C(F)(F)F)Cc1cccc(OC(F)(F)C(F)F)c1 Show InChI InChI=1S/C21H22F7NO3/c1-13(2)31-16-7-4-6-15(10-16)29(12-18(30)20(24,25)26)11-14-5-3-8-17(9-14)32-21(27,28)19(22)23/h3-10,13,18-19,30H,11-12H2,1-2H3 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128182
(1,1,1-Trifluoro-3-{[3-(3-fluoro-phenoxy)-phenyl]-[...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cccc(F)c2)c1)C(F)(F)F Show InChI InChI=1S/C24H19F8NO3/c25-16-5-2-7-18(11-16)35-19-8-3-6-17(12-19)33(14-21(34)23(28,29)30)13-15-4-1-9-20(10-15)36-24(31,32)22(26)27/h1-12,21-22,34H,13-14H2 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128150
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(cyclop...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OC2CCCC2)c1)C(F)(F)F Show InChI InChI=1S/C23H24F7NO3/c24-21(25)23(29,30)34-19-10-3-5-15(11-19)13-31(14-20(32)22(26,27)28)16-6-4-9-18(12-16)33-17-7-1-2-8-17/h3-6,9-12,17,20-21,32H,1-2,7-8,13-14H2 | 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 | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128134
(1,1,1-Trifluoro-3-{[3-(4-isopropyl-phenoxy)-phenyl...)Show SMILES CC(C)c1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1 Show InChI InChI=1S/C27H26F7NO3/c1-17(2)19-9-11-21(12-10-19)37-22-7-4-6-20(14-22)35(16-24(36)26(30,31)32)15-18-5-3-8-23(13-18)38-27(33,34)25(28)29/h3-14,17,24-25,36H,15-16H2,1-2H3 | 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 | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128180
(1,1,1-Trifluoro-3-{[3-(2-nitro-phenoxy)-phenyl]-[3...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccccc2[N+]([O-])=O)c1)C(F)(F)F Show InChI InChI=1S/C24H19F7N2O5/c25-22(26)24(30,31)38-18-8-3-5-15(11-18)13-32(14-21(34)23(27,28)29)16-6-4-7-17(12-16)37-20-10-2-1-9-19(20)33(35)36/h1-12,21-22,34H,13-14H2 | 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 | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128171
(1,1,1-Trifluoro-3-{[3-(1,1,2,2-tetrafluoro-ethoxy)...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(OC(F)(F)F)cc2)c1)C(F)(F)F Show InChI InChI=1S/C25H19F10NO4/c26-22(27)24(31,32)39-20-6-1-3-15(11-20)13-36(14-21(37)23(28,29)30)16-4-2-5-19(12-16)38-17-7-9-18(10-8-17)40-25(33,34)35/h1-12,21-22,37H,13-14H2 | 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 | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118038
(1,1,1,3,3,3-Hexafluoro-2-(3-{[(3-phenoxy-phenyl)-(...)Show SMILES OC(CN(Cc1cccc(c1)C(O)(C(F)(F)F)C(F)(F)F)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C25H20F9NO3/c26-23(27,28)21(36)15-35(18-8-5-11-20(13-18)38-19-9-2-1-3-10-19)14-16-6-4-7-17(12-16)22(37,24(29,30)31)25(32,33)34/h1-13,21,36-37H,14-15H2 | 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 | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50100997
(1,1,1-Trifluoro-3-[(3-furan-2-yl-benzyl)-(3-phenox...)Show SMILES OC(CN(Cc1cccc(c1)-c1ccco1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C26H22F3NO3/c27-26(28,29)25(31)18-30(17-19-7-4-8-20(15-19)24-13-6-14-32-24)21-9-5-12-23(16-21)33-22-10-2-1-3-11-22/h1-16,25,31H,17-18H2 | 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 | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128174
(1,1,1-Trifluoro-3-{[3-(4-nitro-phenoxy)-phenyl]-[3...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(cc2)[N+]([O-])=O)c1)C(F)(F)F Show InChI InChI=1S/C24H19F7N2O5/c25-22(26)24(30,31)38-20-6-1-3-15(11-20)13-32(14-21(34)23(27,28)29)17-4-2-5-19(12-17)37-18-9-7-16(8-10-18)33(35)36/h1-12,21-22,34H,13-14H2 | 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 | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118050
(3-((3-tert-butoxybenzyl)(3-phenoxyphenyl)amino)-1,...)Show SMILES CC(C)(C)Oc1cccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)c1 Show InChI InChI=1S/C26H28F3NO3/c1-25(2,3)33-23-14-7-9-19(15-23)17-30(18-24(31)26(27,28)29)20-10-8-13-22(16-20)32-21-11-5-4-6-12-21/h4-16,24,31H,17-18H2,1-3H3 | 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 | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128151
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-amin...)Show SMILES Nc1ccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)cc1 Show InChI InChI=1S/C24H21F7N2O3/c25-22(26)24(30,31)36-20-6-1-3-15(11-20)13-33(14-21(34)23(27,28)29)17-4-2-5-19(12-17)35-18-9-7-16(32)8-10-18/h1-12,21-22,34H,13-14,32H2 | 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 | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101002
(1,1,1-Trifluoro-3-[(4-fluoro-3-furan-2-yl-benzyl)-...)Show SMILES OC(CN(Cc1ccc(F)c(c1)-c1ccco1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C26H21F4NO3/c27-23-12-11-18(14-22(23)24-10-5-13-33-24)16-31(17-25(32)26(28,29)30)19-6-4-9-21(15-19)34-20-7-2-1-3-8-20/h1-15,25,32H,16-17H2 | 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 | 720 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50100996
(1,1,1-Trifluoro-3-[(3-furan-3-yl-benzyl)-(3-phenox...)Show SMILES OC(CN(Cc1cccc(c1)-c1ccoc1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C26H22F3NO3/c27-26(28,29)25(31)17-30(16-19-6-4-7-20(14-19)21-12-13-32-18-21)22-8-5-11-24(15-22)33-23-9-2-1-3-10-23/h1-15,18,25,31H,16-17H2 | 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 | 910 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118033
(1,1,1-Trifluoro-3-{(3-phenoxy-phenyl)-[3-(2,2,2-tr...)Show SMILES OC(CN(Cc1cccc(OCC(F)(F)F)c1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C24H21F6NO3/c25-23(26,27)16-33-20-10-4-6-17(12-20)14-31(15-22(32)24(28,29)30)18-7-5-11-21(13-18)34-19-8-2-1-3-9-19/h1-13,22,32H,14-16H2 | 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 | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118048
(3-((3-cyclopropylbenzyl)(3-phenoxyphenyl)amino)-1,...)Show SMILES OC(CN(Cc1cccc(c1)C1CC1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C25H24F3NO2/c26-25(27,28)24(30)17-29(16-18-6-4-7-20(14-18)19-12-13-19)21-8-5-11-23(15-21)31-22-9-2-1-3-10-22/h1-11,14-15,19,24,30H,12-13,16-17H2 | 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 | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094514
(1,1,1-Trifluoro-3-[(3-phenoxy-phenyl)-(3-trifluoro...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)F)c1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C23H19F6NO3/c24-22(25,26)21(31)15-30(14-16-6-4-11-20(12-16)33-23(27,28)29)17-7-5-10-19(13-17)32-18-8-2-1-3-9-18/h1-13,21,31H,14-15H2 | 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 | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128130
(1,1,1-Trifluoro-3-{[3-(3-methoxy-phenoxy)-phenyl]-...)Show SMILES COc1cccc(Oc2cccc(c2)N(CC(O)C(F)(F)F)Cc2cccc(OC(F)(F)C(F)F)c2)c1 Show InChI InChI=1S/C25H22F7NO4/c1-35-18-7-4-9-20(13-18)36-19-8-3-6-17(12-19)33(15-22(34)24(28,29)30)14-16-5-2-10-21(11-16)37-25(31,32)23(26)27/h2-13,22-23,34H,14-15H2,1H3 | 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 | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50100999
(1,1,1-Trifluoro-3-[(3-phenoxy-phenyl)-(3-thiophen-...)Show SMILES OC(CN(Cc1cccc(c1)-c1cccs1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C26H22F3NO2S/c27-26(28,29)25(31)18-30(17-19-7-4-8-20(15-19)24-13-6-14-33-24)21-9-5-12-23(16-21)32-22-10-2-1-3-11-22/h1-16,25,31H,17-18H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 1.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118053
(1,1,1-Trifluoro-3-{(3-phenoxy-phenyl)-[3-(3,3,3-tr...)Show SMILES OC(COc1cccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)c1)C(F)(F)F Show InChI InChI=1S/C25H23F6NO4/c26-24(27,28)22(33)15-32(18-7-5-11-21(13-18)36-19-8-2-1-3-9-19)14-17-6-4-10-20(12-17)35-16-23(34)25(29,30)31/h1-13,22-23,33-34H,14-16H2 | 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 | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128163
(1,1,1-Trifluoro-3-{[3-(pyridin-3-yloxy)-phenyl]-[3...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2cccnc2)c1)C(F)(F)F Show InChI InChI=1S/C23H19F7N2O3/c24-21(25)23(29,30)35-18-7-1-4-15(10-18)13-32(14-20(33)22(26,27)28)16-5-2-6-17(11-16)34-19-8-3-9-31-12-19/h1-12,20-21,33H,13-14H2 | 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 | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118032
(1,1,1-Trifluoro-3-[(3-trifluoromethoxy-benzyl)-(3-...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)F)c1)c1cccc(OC(F)(F)F)c1)C(F)(F)F Show InChI InChI=1S/C18H14F9NO3/c19-16(20,21)15(29)10-28(12-4-2-6-14(8-12)31-18(25,26)27)9-11-3-1-5-13(7-11)30-17(22,23)24/h1-8,15,29H,9-10H2 | 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 | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101003
(3-((3-ethoxybenzyl)(3-phenoxyphenyl)amino)-1,1,1-t...)Show SMILES CCOc1cccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)c1 Show InChI InChI=1S/C24H24F3NO3/c1-2-30-21-12-6-8-18(14-21)16-28(17-23(29)24(25,26)27)19-9-7-13-22(15-19)31-20-10-4-3-5-11-20/h3-15,23,29H,2,16-17H2,1H3 | 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 | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128144
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(4-benz...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(Cc3ccccc3)cc2)c1)C(F)(F)F Show InChI InChI=1S/C31H26F7NO3/c32-29(33)31(37,38)42-27-11-4-8-23(17-27)19-39(20-28(40)30(34,35)36)24-9-5-10-26(18-24)41-25-14-12-22(13-15-25)16-21-6-2-1-3-7-21/h1-15,17-18,28-29,40H,16,19-20H2 | 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 | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128179
(3-((3-(biphenyl-4-yloxy)phenyl)(3-(1,1,2,2-tetrafl...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(cc2)-c2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C30H24F7NO3/c31-28(32)30(36,37)41-26-11-4-6-20(16-26)18-38(19-27(39)29(33,34)35)23-9-5-10-25(17-23)40-24-14-12-22(13-15-24)21-7-2-1-3-8-21/h1-17,27-28,39H,18-19H2 | 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 | 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128178
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(cycloh...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(OC2CCCCC2)c1)C(F)(F)F Show InChI InChI=1S/C24H26F7NO3/c25-22(26)24(30,31)35-20-11-4-6-16(12-20)14-32(15-21(33)23(27,28)29)17-7-5-10-19(13-17)34-18-8-2-1-3-9-18/h4-7,10-13,18,21-22,33H,1-3,8-9,14-15H2 | 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 | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50128172
(4-(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3,3,3-...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(Oc2ccc(O)cc2)c1)C(F)(F)F Show InChI InChI=1S/C24H20F7NO4/c25-22(26)24(30,31)36-20-6-1-3-15(11-20)13-32(14-21(34)23(27,28)29)16-4-2-5-19(12-16)35-18-9-7-17(33)8-10-18/h1-12,21-22,33-34H,13-14H2 | 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 | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217127
(1-((3-(trifluoromethoxy)benzyl)(3-phenoxyphenyl)am...)Show SMILES CCCCC(O)CN(Cc1cccc(OC(F)(F)F)c1)c1cccc(Oc2ccccc2)c1 |w:4.4| Show InChI InChI=1S/C26H28F3NO3/c1-2-3-11-22(31)19-30(18-20-9-7-15-25(16-20)33-26(27,28)29)21-10-8-14-24(17-21)32-23-12-5-4-6-13-23/h4-10,12-17,22,31H,2-3,11,18-19H2,1H3 | 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 | 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101008
(1,1,1-Trifluoro-3-[(3-furan-2-yl-4-methyl-benzyl)-...)Show SMILES Cc1ccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)cc1-c1ccco1 Show InChI InChI=1S/C27H24F3NO3/c1-19-12-13-20(15-24(19)25-11-6-14-33-25)17-31(18-26(32)27(28,29)30)21-7-5-10-23(16-21)34-22-8-3-2-4-9-22/h2-16,26,32H,17-18H2,1H3 | 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 | 3.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217132
(3-((3-(6-(trifluoromethyl)pyridin-2-yl)benzyl)(3-p...)Show SMILES OC(CN(Cc1cccc(c1)-c1cccc(n1)C(F)(F)F)c1cccc(Oc2ccccc2)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C28H22F6N2O2/c29-27(30,31)25-14-6-13-24(35-25)20-8-4-7-19(15-20)17-36(18-26(37)28(32,33)34)21-9-5-12-23(16-21)38-22-10-2-1-3-11-22/h1-16,26,37H,17-18H2 | 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 | 4.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101000
(3-((biphenyl-3-ylmethyl)(3-phenoxyphenyl)amino)-1,...)Show SMILES OC(CN(Cc1cccc(c1)-c1ccccc1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C28H24F3NO2/c29-28(30,31)27(33)20-32(19-21-9-7-12-23(17-21)22-10-3-1-4-11-22)24-13-8-16-26(18-24)34-25-14-5-2-6-15-25/h1-18,27,33H,19-20H2 | 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 | 4.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118056
(1,1,1-Trifluoro-3-[(3-phenoxy-benzyl)-(3-phenoxy-p...)Show SMILES OC(CN(Cc1cccc(Oc2ccccc2)c1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C28H24F3NO3/c29-28(30,31)27(33)20-32(22-10-8-16-26(18-22)35-24-13-5-2-6-14-24)19-21-9-7-15-25(17-21)34-23-11-3-1-4-12-23/h1-18,27,33H,19-20H2 | 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 | 5.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217134
(3-((3-(1,1,2,2-tetrafluoroethoxy)benzyl)(3-(pyridi...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)C(F)F)c1)c1cccc(c1)-c1ccncc1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C23H19F7N2O2/c24-21(25)23(29,30)34-19-6-1-3-15(11-19)13-32(14-20(33)22(26,27)28)18-5-2-4-17(12-18)16-7-9-31-10-8-16/h1-12,20-21,33H,13-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217135
(3-((3-(pyrimidin-4-yl)benzyl)(3-phenoxyphenyl)amin...)Show SMILES OC(CN(Cc1cccc(c1)-c1ccncn1)c1cccc(Oc2ccccc2)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C26H22F3N3O2/c27-26(28,29)25(33)17-32(16-19-6-4-7-20(14-19)24-12-13-30-18-31-24)21-8-5-11-23(15-21)34-22-9-2-1-3-10-22/h1-15,18,25,33H,16-17H2 | 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 | 6.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101009
(1,1,1-Trifluoro-3-[[3-(1-methyl-1H-pyrrol-2-yl)-be...)Show SMILES Cn1cccc1-c1cccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)c1 Show InChI InChI=1S/C27H25F3N2O2/c1-31-15-7-14-25(31)21-9-5-8-20(16-21)18-32(19-26(33)27(28,29)30)22-10-6-13-24(17-22)34-23-11-3-2-4-12-23/h2-17,26,33H,18-19H2,1H3 | 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 | 6.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217126
(1,1,1-trifluoro-3-{[3-(1-hydroxy-1-methyl-ethyl)-p...)Show SMILES CC(C)(O)c1cccc(c1)N(CC(O)C(F)(F)F)Cc1cccc(OC(F)(F)C(F)F)c1 |w:12.13| Show InChI InChI=1S/C21H22F7NO3/c1-19(2,31)14-6-4-7-15(10-14)29(12-17(30)20(24,25)26)11-13-5-3-8-16(9-13)32-21(27,28)18(22)23/h3-10,17-18,30-31H,11-12H2,1-2H3 | 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 | 7.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118065
(1,1,1-Trifluoro-3-[m-tolyl-(3-trifluoromethyl-benz...)Show SMILES Cc1cccc(c1)N(CC(O)C(F)(F)F)Cc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C18H17F6NO/c1-12-4-2-7-15(8-12)25(11-16(26)18(22,23)24)10-13-5-3-6-14(9-13)17(19,20)21/h2-9,16,26H,10-11H2,1H3 | 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 | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118047
(1,1,1-Trifluoro-3-[(3-trifluoromethyl-benzyl)-(3-t...)Show SMILES OC(CN(Cc1cccc(c1)C(F)(F)F)c1cccc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C18H14F9NO/c19-16(20,21)12-4-1-3-11(7-12)9-28(10-15(29)18(25,26)27)14-6-2-5-13(8-14)17(22,23)24/h1-8,15,29H,9-10H2 | 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 | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118031
(3-((3-(trifluoromethyl)benzyl)(3-chlorophenyl)amin...)Show SMILES OC(CN(Cc1cccc(c1)C(F)(F)F)c1cccc(Cl)c1)C(F)(F)F Show InChI InChI=1S/C17H14ClF6NO/c18-13-5-2-6-14(8-13)25(10-15(26)17(22,23)24)9-11-3-1-4-12(7-11)16(19,20)21/h1-8,15,26H,9-10H2 | 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 | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094516
(1,1,1-Trifluoro-3-[(3-fluoro-phenyl)-(3-trifluorom...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C17H14F7NO2/c18-12-4-2-5-13(8-12)25(10-15(26)16(19,20)21)9-11-3-1-6-14(7-11)27-17(22,23)24/h1-8,15,26H,9-10H2 | 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 | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217124
(1,1,1-trifluoro-3-((3-phenoxyphenyl)((2,2,3,3-tetr...)Show SMILES OC(CN(Cc1cccc2OC(F)(F)C(F)(F)Oc12)c1cccc(Oc2ccccc2)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C24H18F7NO4/c25-22(26,27)20(33)14-32(16-7-5-10-18(12-16)34-17-8-2-1-3-9-17)13-15-6-4-11-19-21(15)36-24(30,31)23(28,29)35-19/h1-12,20,33H,13-14H2 | 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 | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101001
(1,1,1-Trifluoro-3-[(3-phenoxy-phenyl)-(3-pyridin-3...)Show SMILES OC(CN(Cc1cccc(c1)-c1cccnc1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C27H23F3N2O2/c28-27(29,30)26(33)19-32(18-20-7-4-8-21(15-20)22-9-6-14-31-17-22)23-10-5-13-25(16-23)34-24-11-2-1-3-12-24/h1-17,26,33H,18-19H2 | 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 | 1.43E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094520
(1,1,1-Trifluoro-3-[(3-fluoro-phenyl)-(4-trifluorom...)Show SMILES OC(CN(Cc1ccc(OC(F)(F)F)cc1)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C17H14F7NO2/c18-12-2-1-3-13(8-12)25(10-15(26)16(19,20)21)9-11-4-6-14(7-5-11)27-17(22,23)24/h1-8,15,26H,9-10H2 | 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 | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118054
(1,1,1-Trifluoro-3-[(3-fluoro-phenyl)-(3-phenoxy-be...)Show SMILES OC(CN(Cc1cccc(Oc2ccccc2)c1)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C22H19F4NO2/c23-17-7-5-8-18(13-17)27(15-21(28)22(24,25)26)14-16-6-4-11-20(12-16)29-19-9-2-1-3-10-19/h1-13,21,28H,14-15H2 | 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 | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217133
(3-((3-(6-methylpyridin-2-yl)benzyl)(3-phenoxypheny...)Show SMILES Cc1cccc(n1)-c1cccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)c1 |w:15.16| Show InChI InChI=1S/C28H25F3N2O2/c1-20-8-5-15-26(32-20)22-10-6-9-21(16-22)18-33(19-27(34)28(29,30)31)23-11-7-14-25(17-23)35-24-12-3-2-4-13-24/h2-17,27,34H,18-19H2,1H3 | 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 | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094521
(1,1,1-Trifluoro-3-[phenyl-(3-trifluoromethyl-benzy...)Show SMILES OC(CN(Cc1cccc(c1)C(F)(F)F)c1ccccc1)C(F)(F)F Show InChI InChI=1S/C17H15F6NO/c18-16(19,20)13-6-4-5-12(9-13)10-24(11-15(25)17(21,22)23)14-7-2-1-3-8-14/h1-9,15,25H,10-11H2 | 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 | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118063
(3-{[(3-Phenoxy-phenyl)-(3,3,3-trifluoro-2-hydroxy-...)Show SMILES COC(=O)c1cccc(CN(CC(O)C(F)(F)F)c2cccc(Oc3ccccc3)c2)c1 Show InChI InChI=1S/C24H22F3NO4/c1-31-23(30)18-8-5-7-17(13-18)15-28(16-22(29)24(25,26)27)19-9-6-12-21(14-19)32-20-10-3-2-4-11-20/h2-14,22,29H,15-16H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118046
(3-((biphenyl-4-ylmethyl)(3-fluorophenyl)amino)-1,1...)Show SMILES OC(CN(Cc1ccc(cc1)-c1ccccc1)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C22H19F4NO/c23-19-7-4-8-20(13-19)27(15-21(28)22(24,25)26)14-16-9-11-18(12-10-16)17-5-2-1-3-6-17/h1-13,21,28H,14-15H2 | 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 | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50101010
(1,1,1-Trifluoro-3-[(3-phenoxy-phenyl)-(3-pyridin-2...)Show SMILES OC(CN(Cc1cccc(c1)-c1ccccn1)c1cccc(Oc2ccccc2)c1)C(F)(F)F Show InChI InChI=1S/C27H23F3N2O2/c28-27(29,30)26(33)19-32(18-20-8-6-9-21(16-20)25-14-4-5-15-31-25)22-10-7-13-24(17-22)34-23-11-2-1-3-12-23/h1-17,26,33H,18-19H2 | 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 | 2.29E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094517
(1,1,1-Trifluoro-3-[(4-phenoxy-phenyl)-(3-trifluoro...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)F)c1)c1ccc(Oc2ccccc2)cc1)C(F)(F)F Show InChI InChI=1S/C23H19F6NO3/c24-22(25,26)21(31)15-30(14-16-5-4-8-20(13-16)33-23(27,28)29)17-9-11-19(12-10-17)32-18-6-2-1-3-7-18/h1-13,21,31H,14-15H2 | 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 | 2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50094518
(1,1,1-Trifluoro-3-[(3-fluoro-phenyl)-(3-trifluorom...)Show SMILES OC(CN(Cc1cccc(c1)C(F)(F)F)c1cccc(F)c1)C(F)(F)F Show InChI InChI=1S/C17H14F7NO/c18-13-5-2-6-14(8-13)25(10-15(26)17(22,23)24)9-11-3-1-4-12(7-11)16(19,20)21/h1-8,15,26H,9-10H2 | 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 | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50217125
(3-((3-(furan-2-yl)-4-morpholinobenzyl)(3-phenoxyph...)Show SMILES OC(CN(Cc1ccc(N2CCCCO2)c(c1)-c1ccco1)c1cccc(Oc2ccccc2)c1)C(F)(F)F |w:1.0| Show InChI InChI=1S/C30H29F3N2O4/c31-30(32,33)29(36)21-34(23-8-6-11-25(19-23)39-24-9-2-1-3-10-24)20-22-13-14-27(35-15-4-5-17-38-35)26(18-22)28-12-7-16-37-28/h1-3,6-14,16,18-19,29,36H,4-5,15,17,20-21H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118055
(2-((3-(trifluoromethoxy)benzyl)(3-phenoxyphenyl)am...)Show SMILES OC(CN(Cc1cccc(OC(F)(F)F)c1)c1cccc(Oc2ccccc2)c1)c1ccccc1 Show InChI InChI=1S/C28H24F3NO3/c29-28(30,31)35-26-16-7-9-21(17-26)19-32(20-27(33)22-10-3-1-4-11-22)23-12-8-15-25(18-23)34-24-13-5-2-6-14-24/h1-18,27,33H,19-20H2 | 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 |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
Cholesteryl ester transfer protein
(Homo sapiens (Human)) | BDBM50118042
(1,1,1-Trifluoro-3-[(3-fluoro-phenyl)-(4-methyl-ben...)Show InChI InChI=1S/C17H17F4NO/c1-12-5-7-13(8-6-12)10-22(11-16(23)17(19,20)21)15-4-2-3-14(18)9-15/h2-9,16,23H,10-11H2,1H3 | 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 | 6.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Federal da Bahia
Curated by ChEMBL
| Assay Description
Inhibition of CETP |
Bioorg Med Chem 15: 6242-52 (2007)
Article DOI: 10.1016/j.bmc.2007.06.021
BindingDB Entry DOI: 10.7270/Q2B857VG |
More data for this
Ligand-Target Pair | |
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