Found 68 hits of ic50 for UniProtKB: P12785 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189474
(7-fluoro-4-hydroxy-6-nitro-3-phenylquinolin-2(1H)-...)Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2cc(F)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C15H9FN2O4/c16-10-7-11-9(6-12(10)18(21)22)14(19)13(15(20)17-11)8-4-2-1-3-5-8/h1-7H,(H2,17,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426433
(CHEMBL2322360)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)N1CCCC1 Show InChI InChI=1S/C31H32N6O/c1-20-15-21(2)26(31(38)37-13-9-24(10-14-37)23-7-5-22(18-32)6-8-23)16-25(20)30-34-27-17-29(33-19-28(27)35-30)36-11-3-4-12-36/h5-8,15-17,19,24H,3-4,9-14H2,1-2H3,(H,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 62 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of FASN in rat NMU cells assessed as reduction of de novo synthesis of palmitate |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189472
(7-chloro-4-hydroxy-6-nitro-3-phenylquinolin-2(1H)-...)Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C15H9ClN2O4/c16-10-7-11-9(6-12(10)18(21)22)14(19)13(15(20)17-11)8-4-2-1-3-5-8/h1-7H,(H2,17,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189486
(3-(4-(benzyloxy)phenyl)-7-chloro-4-hydroxy-6-nitro...)Show SMILES Oc1c(-c2ccc(OCc3ccccc3)cc2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C22H15ClN2O5/c23-17-11-18-16(10-19(17)25(28)29)21(26)20(22(27)24-18)14-6-8-15(9-7-14)30-12-13-4-2-1-3-5-13/h1-11H,12H2,(H2,24,26,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 86 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189484
(3-biphenyl-4-yl-7-chloro-4-hydroxy-6-nitro-1H-quin...)Show SMILES Oc1c(-c2ccc(cc2)-c2ccccc2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C21H13ClN2O4/c22-16-11-17-15(10-18(16)24(27)28)20(25)19(21(26)23-17)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H2,23,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 122 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189470
(7-chloro-3-(3,5-dichlorophenyl)-4-hydroxy-6-nitroq...)Show SMILES Oc1c(-c2cc(Cl)cc(Cl)c2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C15H7Cl3N2O4/c16-7-1-6(2-8(17)3-7)13-14(21)9-4-12(20(23)24)10(18)5-11(9)19-15(13)22/h1-5H,(H2,19,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 134 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426433
(CHEMBL2322360)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)N1CCCC1 Show InChI InChI=1S/C31H32N6O/c1-20-15-21(2)26(31(38)37-13-9-24(10-14-37)23-7-5-22(18-32)6-8-23)16-25(20)30-34-27-17-29(33-19-28(27)35-30)36-11-3-4-12-36/h5-8,15-17,19,24H,3-4,9-14H2,1-2H3,(H,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189475
(7-chloro-3-(3,5-difluorophenyl)-4-hydroxy-6-nitroq...)Show SMILES Oc1c(-c2cc(F)cc(F)c2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C15H7ClF2N2O4/c16-10-5-11-9(4-12(10)20(23)24)14(21)13(15(22)19-11)6-1-7(17)3-8(18)2-6/h1-5H,(H2,19,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 172 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189482
(7-chloro-3-(2,4-difluorophenyl)-4-hydroxy-6-nitroq...)Show SMILES Oc1c(-c2ccc(F)cc2F)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O |(-1.13,-20.47,;-1.13,-22.01,;.22,-22.79,;1.55,-22.02,;1.55,-20.49,;2.88,-19.72,;4.22,-20.49,;5.56,-19.73,;4.22,-22.04,;2.88,-22.8,;2.88,-24.34,;.21,-24.34,;1.55,-25.12,;-1.13,-25.12,;-2.47,-24.34,;-3.8,-25.11,;-5.13,-24.34,;-6.47,-25.11,;-5.13,-22.79,;-3.8,-22.02,;-2.47,-22.79,;-6.46,-22.02,;-6.47,-20.48,;-7.8,-22.79,)| Show InChI InChI=1S/C15H7ClF2N2O4/c16-9-5-11-8(4-12(9)20(23)24)14(21)13(15(22)19-11)7-2-1-6(17)3-10(7)18/h1-5H,(H2,19,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 173 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426434
(CHEMBL2322359)Show SMILES COCCN(C)c1cc2nc([nH]c2cn1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C Show InChI InChI=1S/C31H34N6O2/c1-20-15-21(2)26(31(38)37-11-9-24(10-12-37)23-7-5-22(18-32)6-8-23)16-25(20)30-34-27-17-29(33-19-28(27)35-30)36(3)13-14-39-4/h5-8,15-17,19,24H,9-14H2,1-4H3,(H,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 316 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426435
(CHEMBL2322370)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)N1CCOCC1 Show InChI InChI=1S/C31H32N6O2/c1-20-15-21(2)26(31(38)37-9-7-24(8-10-37)23-5-3-22(18-32)4-6-23)16-25(20)30-34-27-17-29(33-19-28(27)35-30)36-11-13-39-14-12-36/h3-6,15-17,19,24H,7-14H2,1-2H3,(H,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 316 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426429
(CHEMBL2322364)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2nc(ccc2[nH]1)N1CCC1 Show InChI InChI=1S/C30H30N6O/c1-19-16-20(2)25(30(37)36-14-10-23(11-15-36)22-6-4-21(18-31)5-7-22)17-24(19)28-32-26-8-9-27(33-29(26)34-28)35-12-3-13-35/h4-9,16-17,23H,3,10-15H2,1-2H3,(H,32,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 325 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426432
(CHEMBL2322361)Show SMILES Cc1ccc(cc1-c1nc2cc(ncc2[nH]1)N1CCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C29H28N6O/c1-19-3-6-23(29(36)35-13-9-22(10-14-35)21-7-4-20(17-30)5-8-21)15-24(19)28-32-25-16-27(34-11-2-12-34)31-18-26(25)33-28/h3-8,15-16,18,22H,2,9-14H2,1H3,(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 397 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189460
(7-chloro-3-(2,4-dichlorophenyl)-4-hydroxy-6-nitroq...)Show SMILES Oc1c(-c2ccc(Cl)cc2Cl)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O |(16.28,-10.83,;16.28,-12.37,;17.63,-13.15,;18.96,-12.39,;18.96,-10.85,;20.29,-10.08,;21.63,-10.86,;22.97,-10.09,;21.63,-12.4,;20.29,-13.16,;20.29,-14.7,;17.63,-14.71,;18.96,-15.48,;16.28,-15.48,;14.94,-14.7,;13.61,-15.47,;12.28,-14.7,;10.94,-15.47,;12.28,-13.15,;13.61,-12.38,;14.94,-13.15,;10.95,-12.38,;10.95,-10.84,;9.61,-13.15,)| Show InChI InChI=1S/C15H7Cl3N2O4/c16-6-1-2-7(9(17)3-6)13-14(21)8-4-12(20(23)24)10(18)5-11(8)19-15(13)22/h1-5H,(H2,19,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 443 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426428
(CHEMBL2322365)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2ccnc(N3CCC3)c2[nH]1 Show InChI InChI=1S/C30H30N6O/c1-19-16-20(2)25(30(37)36-14-9-23(10-15-36)22-6-4-21(18-31)5-7-22)17-24(19)28-33-26-8-11-32-29(27(26)34-28)35-12-3-13-35/h4-8,11,16-17,23H,3,9-10,12-15H2,1-2H3,(H,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 510 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189455
(4-hydroxy-6-nitro-3-phenylquinolin-2(1H)-one | CHE...)Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2ccc(cc12)[N+]([O-])=O Show InChI InChI=1S/C15H10N2O4/c18-14-11-8-10(17(20)21)6-7-12(11)16-15(19)13(14)9-4-2-1-3-5-9/h1-8H,(H2,16,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426443
(CHEMBL2322374)Show SMILES Cc1ccc(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)N1CCCC1 Show InChI InChI=1S/C30H30N6O/c1-20-4-7-24(29-33-26-17-28(32-19-27(26)34-29)35-12-2-3-13-35)16-25(20)30(37)36-14-10-23(11-15-36)22-8-5-21(18-31)6-9-22/h4-9,16-17,19,23H,2-3,10-15H2,1H3,(H,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 635 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189466
(7-chloro-4-hydroxy-6-nitro-3-(thiophen-2-yl)quinol...)Show SMILES Oc1c(-c2cccs2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C13H7ClN2O4S/c14-7-5-8-6(4-9(7)16(19)20)12(17)11(13(18)15-8)10-2-1-3-21-10/h1-5H,(H2,15,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267073
(2-Undecyl-4-methylene-5-oxo-tetrahydro-thiophene-3...)Show SMILES CCCCCCCCCCC[C@H]1SC(=O)C(=C)[C@@H]1C(O)=O |r| Show InChI InChI=1S/C17H28O3S/c1-3-4-5-6-7-8-9-10-11-12-14-15(16(18)19)13(2)17(20)21-14/h14-15H,2-12H2,1H3,(H,18,19)/t14-,15+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 790 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267072
(2-Decyl-4-methylene-5-oxo-tetrahydro-thiophene-3-c...)Show SMILES CCCCCCCCCC[C@H]1SC(=O)C(=C)[C@@H]1C(O)=O |r| Show InChI InChI=1S/C16H26O3S/c1-3-4-5-6-7-8-9-10-11-13-14(15(17)18)12(2)16(19)20-13/h13-14H,2-11H2,1H3,(H,17,18)/t13-,14+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426446
(CHEMBL2322371)Show SMILES Cc1ccc(cc1-c1nc2cc(ncc2[nH]1)N1CCCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C30H30N6O/c1-20-4-7-24(30(37)36-14-10-23(11-15-36)22-8-5-21(18-31)6-9-22)16-25(20)29-33-26-17-28(32-19-27(26)34-29)35-12-2-3-13-35/h4-9,16-17,19,23H,2-3,10-15H2,1H3,(H,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267071
(2-Nonyl-4-methylene-5-oxo-tetrahydro-thiophene-3-c...)Show SMILES CCCCCCCCC[C@H]1SC(=O)C(=C)[C@@H]1C(O)=O |r| Show InChI InChI=1S/C15H24O3S/c1-3-4-5-6-7-8-9-10-12-13(14(16)17)11(2)15(18)19-12/h12-13H,2-10H2,1H3,(H,16,17)/t12-,13+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426431
(CHEMBL2322362)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)S(C)(=O)=O Show InChI InChI=1S/C28H27N5O3S/c1-17-12-18(2)23(13-22(17)27-31-24-14-26(37(3,35)36)30-16-25(24)32-27)28(34)33-10-8-21(9-11-33)20-6-4-19(15-29)5-7-20/h4-7,12-14,16,21H,8-11H2,1-3H3,(H,31,32) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267033
(2-Octyl-4-methylene-5-oxo-tetrahydro-thiophene-3-c...)Show InChI InChI=1S/C14H22O3S/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)/t11-,12+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189458
(7-chloro-4-hydroxy-6-nitro-3-(1H-tetrazol-5-yl)qui...)Show SMILES Oc1c(-c2nnn[nH]2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C10H5ClN6O4/c11-4-2-5-3(1-6(4)17(20)21)8(18)7(10(19)12-5)9-13-15-16-14-9/h1-2H,(H2,12,18,19)(H,13,14,15,16) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426445
(CHEMBL2322372)Show SMILES O=C(N1CCC(CC1)c1ccc(cc1)C#N)c1cccc(c1)-c1nc2cc(ncc2[nH]1)N1CCCC1 Show InChI InChI=1S/C29H28N6O/c30-18-20-6-8-21(9-7-20)22-10-14-35(15-11-22)29(36)24-5-3-4-23(16-24)28-32-25-17-27(31-19-26(25)33-28)34-12-1-2-13-34/h3-9,16-17,19,22H,1-2,10-15H2,(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189477
(4-hydroxy-8-nitro-3-phenylquinolin-2(1H)-one | CHE...)Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2c(cccc12)[N+]([O-])=O Show InChI InChI=1S/C15H10N2O4/c18-14-10-7-4-8-11(17(20)21)13(10)16-15(19)12(14)9-5-2-1-3-6-9/h1-8H,(H2,16,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426436
(CHEMBL2322369)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)N1CCNCC1 Show InChI InChI=1S/C31H33N7O/c1-20-15-21(2)26(31(39)38-11-7-24(8-12-38)23-5-3-22(18-32)4-6-23)16-25(20)30-35-27-17-29(34-19-28(27)36-30)37-13-9-33-10-14-37/h3-6,15-17,19,24,33H,7-14H2,1-2H3,(H,35,36) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189492
(7-chloro-4-hydroxy-3-(3-methylisoxazol-5-yl)-6-nit...)Show SMILES Cc1cc(on1)-c1c(O)c2cc(c(Cl)cc2[nH]c1=O)[N+]([O-])=O Show InChI InChI=1S/C13H8ClN3O5/c1-5-2-10(22-16-5)11-12(18)6-3-9(17(20)21)7(14)4-8(6)15-13(11)19/h2-4H,1H3,(H2,15,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256179
((trans)-1-oxo-3-undecylisothiochroman-4-carboxylic...)Show SMILES CCCCCCCCCCC[C@H]1SC(=O)c2ccccc2[C@@H]1C(O)=O |r| Show InChI InChI=1S/C21H30O3S/c1-2-3-4-5-6-7-8-9-10-15-18-19(20(22)23)16-13-11-12-14-17(16)21(24)25-18/h11-14,18-19H,2-10,15H2,1H3,(H,22,23)/t18-,19+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology & Toxicology
Curated by ChEMBL
| Assay Description Inhibition of Sprague-Dawley rat liver fatty acid synthase |
Bioorg Med Chem Lett 19: 770-2 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.010 BindingDB Entry DOI: 10.7270/Q2F76CFQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426437
(CHEMBL2322368)Show SMILES CN1CCN(CC1)c1cc2nc([nH]c2cn1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C Show InChI InChI=1S/C32H35N7O/c1-21-16-22(2)27(32(40)39-10-8-25(9-11-39)24-6-4-23(19-33)5-7-24)17-26(21)31-35-28-18-30(34-20-29(28)36-31)38-14-12-37(3)13-15-38/h4-7,16-18,20,25H,8-15H2,1-3H3,(H,35,36) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426430
(CHEMBL2322363)Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2ncc(cc2[nH]1)S(C)(=O)=O Show InChI InChI=1S/C28H27N5O3S/c1-17-12-18(2)24(14-23(17)26-31-25-13-22(37(3,35)36)16-30-27(25)32-26)28(34)33-10-8-21(9-11-33)20-6-4-19(15-29)5-7-20/h4-7,12-14,16,21H,8-11H2,1-3H3,(H,30,31,32) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50426427
(CHEMBL2322357)Show SMILES Cc1ccc(cc1NC(=O)c1ccc(nc1)N1CCCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C30H31N5O2/c1-21-4-7-25(30(37)35-16-12-24(13-17-35)23-8-5-22(19-31)6-9-23)18-27(21)33-29(36)26-10-11-28(32-20-26)34-14-2-3-15-34/h4-11,18,20,24H,2-3,12-17H2,1H3,(H,33,36) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.97E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description Inhibition of rat FASN assessed as release of co-enzyme A |
ACS Med Chem Lett 4: 113-7 (2013)
Article DOI: 10.1021/ml300335r BindingDB Entry DOI: 10.7270/Q2P84D76 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256178
((trans)-3-decyl-1-oxoisothiochroman-4-carboxylic a...)Show SMILES CCCCCCCCCC[C@H]1SC(=O)c2ccccc2[C@@H]1C(O)=O |r| Show InChI InChI=1S/C20H28O3S/c1-2-3-4-5-6-7-8-9-14-17-18(19(21)22)15-12-10-11-13-16(15)20(23)24-17/h10-13,17-18H,2-9,14H2,1H3,(H,21,22)/t17-,18+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology & Toxicology
Curated by ChEMBL
| Assay Description Inhibition of Sprague-Dawley rat liver fatty acid synthase |
Bioorg Med Chem Lett 19: 770-2 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.010 BindingDB Entry DOI: 10.7270/Q2F76CFQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189489
(7-chloro-4-hydroxy-3-(naphthalen-2-yl)-6-nitroquin...)Show SMILES Oc1c(-c2ccc3ccccc3c2)c(=O)[nH]c2cc(Cl)c(cc12)[N+]([O-])=O Show InChI InChI=1S/C19H11ClN2O4/c20-14-9-15-13(8-16(14)22(25)26)18(23)17(19(24)21-15)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H2,21,23,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256132
((trans)-3-nonyl-1-oxoisothiochroman-4-carboxylic a...)Show InChI InChI=1S/C19H26O3S/c1-2-3-4-5-6-7-8-13-16-17(18(20)21)14-11-9-10-12-15(14)19(22)23-16/h9-12,16-17H,2-8,13H2,1H3,(H,20,21)/t16?,17-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology & Toxicology
Curated by ChEMBL
| Assay Description Inhibition of Sprague-Dawley rat liver fatty acid synthase |
Bioorg Med Chem Lett 19: 770-2 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.010 BindingDB Entry DOI: 10.7270/Q2F76CFQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256131
((trans)-3-octyl-1-oxoisothiochroman-4-carboxylic a...)Show SMILES CCCCCCCC[C@H]1SC(=O)c2ccccc2[C@@H]1C(O)=O |r| Show InChI InChI=1S/C18H24O3S/c1-2-3-4-5-6-7-12-15-16(17(19)20)13-10-8-9-11-14(13)18(21)22-15/h8-11,15-16H,2-7,12H2,1H3,(H,19,20)/t15-,16+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.23E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology & Toxicology
Curated by ChEMBL
| Assay Description Inhibition of Sprague-Dawley rat liver fatty acid synthase |
Bioorg Med Chem Lett 19: 770-2 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.010 BindingDB Entry DOI: 10.7270/Q2F76CFQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50001260
(3-phenyl-4-hydroxyquinolin-2(1H)-one | 4-Hydroxy-3...)Show InChI InChI=1S/C15H11NO2/c17-14-11-8-4-5-9-12(11)16-15(18)13(14)10-6-2-1-3-7-10/h1-9H,(H2,16,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
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 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189461
(4-hydroxy-6-(methylsulfonyl)-3-phenylquinolin-2(1H...)Show SMILES CS(=O)(=O)c1ccc2[nH]c(=O)c(-c3ccccc3)c(O)c2c1 Show InChI InChI=1S/C16H13NO4S/c1-22(20,21)11-7-8-13-12(9-11)15(18)14(16(19)17-13)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD 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 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189467
(4-hydroxy-6-nitroquinolin-2(1H)-one | CHEMBL377915)Show InChI InChI=1S/C9H6N2O4/c12-8-4-9(13)10-7-2-1-5(11(14)15)3-6(7)8/h1-4H,(H2,10,12,13) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
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 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189468
(4-hydroxy-3-phenyl-6-(trifluoromethyl)quinolin-2(1...)Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2ccc(cc12)C(F)(F)F Show InChI InChI=1S/C16H10F3NO2/c17-16(18,19)10-6-7-12-11(8-10)14(21)13(15(22)20-12)9-4-2-1-3-5-9/h1-8H,(H2,20,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD 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 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189469
(4-hydroxy-2-oxo-3-phenyl-1,2-dihydroquinoline-6-ca...)Show InChI InChI=1S/C16H11NO4/c18-14-11-8-10(16(20)21)6-7-12(11)17-15(19)13(14)9-4-2-1-3-5-9/h1-8H,(H,20,21)(H2,17,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD 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 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50189487
(4-hydroxy-3-phenyl-6-(trifluoromethylsulfonyl)quin...)Show SMILES Oc1c(-c2ccccc2)c(=O)[nH]c2ccc(cc12)S(=O)(=O)C(F)(F)F Show InChI InChI=1S/C16H10F3NO4S/c17-16(18,19)25(23,24)10-6-7-12-11(8-10)14(21)13(15(22)20-12)9-4-2-1-3-5-9/h1-8H,(H2,20,21,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD 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 |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of rat FAS |
Bioorg Med Chem Lett 16: 4620-3 (2006)
Article DOI: 10.1016/j.bmcl.2006.06.014 BindingDB Entry DOI: 10.7270/Q2FX7927 |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256128
((2R,3S)-4-methylene-2-octyl-5-oxotetrahydrofuran-3...)Show InChI InChI=1S/C14H22O4/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)/t11-,12+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.55E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256128
((2R,3S)-4-methylene-2-octyl-5-oxotetrahydrofuran-3...)Show InChI InChI=1S/C14H22O4/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)/t11-,12+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.55E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology & Toxicology
Curated by ChEMBL
| Assay Description Inhibition of Sprague-Dawley rat liver fatty acid synthase |
Bioorg Med Chem Lett 19: 770-2 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.010 BindingDB Entry DOI: 10.7270/Q2F76CFQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267032
(2-Hexyl-4-methylene-5-oxo-tetrahydro-thiophene-3-c...)Show InChI InChI=1S/C12H18O3S/c1-3-4-5-6-7-9-10(11(13)14)8(2)12(15)16-9/h9-10H,2-7H2,1H3,(H,13,14)/t9-,10+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.67E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267147
(CHEMBL478136 | trans-3-Undecyl-1-oxo-isochroman-4-...)Show SMILES CCCCCCCCCCC[C@@H]1OC(=O)c2ccccc2[C@H]1C(O)=O |r| Show InChI InChI=1S/C21H30O4/c1-2-3-4-5-6-7-8-9-10-15-18-19(20(22)23)16-13-11-12-14-17(16)21(24)25-18/h11-14,18-19H,2-10,15H2,1H3,(H,22,23)/t18-,19+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267146
(CHEMBL518275 | trans-3-Decyl-1-oxo-isochroman-4-ca...)Show SMILES CCCCCCCCCC[C@@H]1OC(=O)c2ccccc2[C@H]1C(O)=O |r| Show InChI InChI=1S/C20H28O4/c1-2-3-4-5-6-7-8-9-14-17-18(19(21)22)15-12-10-11-13-16(15)20(23)24-17/h10-13,17-18H,2-9,14H2,1H3,(H,21,22)/t17-,18+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50256130
((trans)-3-heptyl-1-oxoisothiochroman-4-carboxylic ...)Show SMILES CCCCCCC[C@H]1SC(=O)c2ccccc2[C@@H]1C(O)=O |r| Show InChI InChI=1S/C17H22O3S/c1-2-3-4-5-6-11-14-15(16(18)19)12-9-7-8-10-13(12)17(20)21-14/h7-10,14-15H,2-6,11H2,1H3,(H,18,19)/t14-,15+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.69E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology & Toxicology
Curated by ChEMBL
| Assay Description Inhibition of Sprague-Dawley rat liver fatty acid synthase |
Bioorg Med Chem Lett 19: 770-2 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.010 BindingDB Entry DOI: 10.7270/Q2F76CFQ |
More data for this Ligand-Target Pair | |
Fatty acid synthase
(Rattus norvegicus) | BDBM50267103
(CHEMBL517501 | trans-4-Isopropylidene-2-undecyl-5-...)Show SMILES [#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6@H]-1-[#8]-[#6](=O)\[#6](-[#6@@H]-1-[#6](-[#8])=O)=[#6](/[#6])-[#6] |r| Show InChI InChI=1S/C19H32O4/c1-4-5-6-7-8-9-10-11-12-13-15-17(18(20)21)16(14(2)3)19(22)23-15/h15,17H,4-13H2,1-3H3,(H,20,21)/t15-,17-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.75E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacology and Toxicology
Curated by ChEMBL
| Assay Description Inhibition of rat liver FAS by Coomassie blue staining |
Bioorg Med Chem 17: 1898-904 (2009)
Article DOI: 10.1016/j.bmc.2009.01.050 BindingDB Entry DOI: 10.7270/Q22F7NBQ |
More data for this Ligand-Target Pair | |