Found 44 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 |
|---|
Fatty acid synthase
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | 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 human HeLa 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | BDBM50426447
(CHEMBL2322358)Show SMILES Cc1ccc(cc1C(=O)Nc1ccc(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)29(36)33-26-10-11-28(32-20-26)34-14-2-3-15-34/h4-11,18,20,24H,2-3,12-17H2,1H3,(H,33,36) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 85 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 107 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | 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
(Homo sapiens (Human)) | BDBM50426439
(CHEMBL2322366)Show SMILES Cc1ccc(cc1-c1nc2cc(ncc2[nH]1)N1CC(O)C1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C29H28N6O2/c1-18-2-5-22(29(37)34-10-8-21(9-11-34)20-6-3-19(14-30)4-7-20)12-24(18)28-32-25-13-27(31-15-26(25)33-28)35-16-23(36)17-35/h2-7,12-13,15,21,23,36H,8-11,16-17H2,1H3,(H,32,33) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | 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
(Homo sapiens (Human)) | BDBM50426441
(CHEMBL2322376)Show SMILES Cc1ccc(cc1-c1nc2ccncc2[nH]1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C26H23N5O/c1-17-2-5-21(14-22(17)25-29-23-8-11-28-16-24(23)30-25)26(32)31-12-9-20(10-13-31)19-6-3-18(15-27)4-7-19/h2-8,11,14,16,20H,9-10,12-13H2,1H3,(H,29,30) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | 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
(Homo sapiens (Human)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 870 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | BDBM50426440
(CHEMBL2322659)Show SMILES Cc1ccc(cc1-c1nc2ccccc2[nH]1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C27H24N4O/c1-18-6-9-22(16-23(18)26-29-24-4-2-3-5-25(24)30-26)27(32)31-14-12-21(13-15-31)20-10-7-19(17-28)8-11-20/h2-11,16,21H,12-15H2,1H3,(H,29,30) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 980 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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
(Homo sapiens (Human)) | BDBM50426438
(CHEMBL2322367)Show SMILES CN1CCN(CC1)c1cc2nc([nH]c2cn1)-c1cc(ccc1C)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C31H33N7O/c1-21-3-6-25(31(39)38-11-9-24(10-12-38)23-7-4-22(19-32)5-8-23)17-26(21)30-34-27-18-29(33-20-28(27)35-30)37-15-13-36(2)14-16-37/h3-8,17-18,20,24H,9-16H2,1-2H3,(H,34,35) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 990 | n/a | n/a | n/a | n/a | n/a | n/a |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | 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) | 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) | 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) | 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) | 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) | BDBM50426447
(CHEMBL2322358)Show SMILES Cc1ccc(cc1C(=O)Nc1ccc(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)29(36)33-26-10-11-28(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 | 2.85E+4 | 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) | BDBM50426439
(CHEMBL2322366)Show SMILES Cc1ccc(cc1-c1nc2cc(ncc2[nH]1)N1CC(O)C1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C29H28N6O2/c1-18-2-5-22(29(37)34-10-8-21(9-11-34)20-6-3-19(14-30)4-7-20)12-24(18)28-32-25-13-27(31-15-26(25)33-28)35-16-23(36)17-35/h2-7,12-13,15,21,23,36H,8-11,16-17H2,1H3,(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 | 3.10E+4 | 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) | BDBM50426442
(CHEMBL2322375)Show SMILES Cc1c(cccc1-c1nc2cc(ncc2[nH]1)N1CCCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C30H30N6O/c1-20-24(29-33-26-17-28(32-19-27(26)34-29)35-13-2-3-14-35)5-4-6-25(20)30(37)36-15-11-23(12-16-36)22-9-7-21(18-31)8-10-22/h4-10,17,19,23H,2-3,11-16H2,1H3,(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 | >5.00E+4 | 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) | BDBM50426441
(CHEMBL2322376)Show SMILES Cc1ccc(cc1-c1nc2ccncc2[nH]1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C26H23N5O/c1-17-2-5-21(14-22(17)25-29-23-8-11-28-16-24(23)30-25)26(32)31-12-9-20(10-13-31)19-6-3-18(15-27)4-7-19/h2-8,11,14,16,20H,9-10,12-13H2,1H3,(H,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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 |
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
(Homo sapiens (Human)) | BDBM50426442
(CHEMBL2322375)Show SMILES Cc1c(cccc1-c1nc2cc(ncc2[nH]1)N1CCCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C30H30N6O/c1-20-24(29-33-26-17-28(32-19-27(26)34-29)35-13-2-3-14-35)5-4-6-25(20)30(37)36-15-11-23(12-16-36)22-9-7-21(18-31)8-10-22/h4-10,17,19,23H,2-3,11-16H2,1H3,(H,33,34) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | BDBM50426438
(CHEMBL2322367)Show SMILES CN1CCN(CC1)c1cc2nc([nH]c2cn1)-c1cc(ccc1C)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C31H33N7O/c1-21-3-6-25(31(39)38-11-9-24(10-12-38)23-7-4-22(19-32)5-8-23)17-26(21)30-34-27-18-29(33-20-28(27)35-30)37-15-13-36(2)14-16-37/h3-8,17-18,20,24H,9-16H2,1-2H3,(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 | >5.00E+4 | 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
(Homo sapiens (Human)) | BDBM50426444
(CHEMBL2322373)Show SMILES Cc1cc(cc(c1)-c1nc2cc(ncc2[nH]1)N1CCCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C30H30N6O/c1-20-14-24(29-33-26-17-28(32-19-27(26)34-29)35-10-2-3-11-35)16-25(15-20)30(37)36-12-8-23(9-13-36)22-6-4-21(18-31)5-7-22/h4-7,14-17,19,23H,2-3,8-13H2,1H3,(H,33,34) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
3-V Biosciences, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human 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) | BDBM50426444
(CHEMBL2322373)Show SMILES Cc1cc(cc(c1)-c1nc2cc(ncc2[nH]1)N1CCCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C30H30N6O/c1-20-14-24(29-33-26-17-28(32-19-27(26)34-29)35-10-2-3-11-35)16-25(15-20)30(37)36-12-8-23(9-13-36)22-6-4-21(18-31)5-7-22/h4-7,14-17,19,23H,2-3,8-13H2,1H3,(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 | >5.00E+4 | 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) | BDBM50426440
(CHEMBL2322659)Show SMILES Cc1ccc(cc1-c1nc2ccccc2[nH]1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N Show InChI InChI=1S/C27H24N4O/c1-18-6-9-22(16-23(18)26-29-24-4-2-3-5-25(24)30-26)27(32)31-14-12-21(13-15-31)20-10-7-19(17-28)8-11-20/h2-11,16,21H,12-15H2,1H3,(H,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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 |
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 | |
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