Found 56 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 |
|---|
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50195026
(CHEMBL223100 | N-(4-(2-(4-propoxyphenoxy)thiazol-5...)Show InChI InChI=1S/C18H20N2O3S/c1-4-11-22-15-6-8-16(9-7-15)23-18-19-12-17(24-18)10-5-13(2)20-14(3)21/h6-9,12-13H,4,11H2,1-3H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203981
(CHEMBL376717 | N-(4-(2-(4-(cyclopropylmethoxy)phen...)Show InChI InChI=1S/C19H20N2O3S/c1-13(21-14(2)22)3-10-18-11-20-19(25-18)24-17-8-6-16(7-9-17)23-12-15-4-5-15/h6-9,11,13,15H,4-5,12H2,1-2H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203970
(CHEMBL232004 | N-(4-(2-(4-isobutoxy-2-methylphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(C)c1 |w:17.18| Show InChI InChI=1S/C20H24N2O3S/c1-13(2)12-24-17-7-9-19(14(3)10-17)25-20-21-11-18(26-20)8-6-15(4)22-16(5)23/h7,9-11,13,15H,12H2,1-5H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50195029
(CHEMBL375532 | N-(4-(2-(4-isobutoxyphenoxy)thiazol...)Show InChI InChI=1S/C19H22N2O3S/c1-13(2)12-23-16-6-8-17(9-7-16)24-19-20-11-18(25-19)10-5-14(3)21-15(4)22/h6-9,11,13-14H,12H2,1-4H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203978
(CHEMBL233384 | N-(4-(2-(2-chloro-4-(cyclopropylmet...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C19H19ClN2O3S/c1-12(22-13(2)23)3-7-16-10-21-19(26-16)25-18-8-6-15(9-17(18)20)24-11-14-4-5-14/h6,8-10,12,14H,4-5,11H2,1-2H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203969
(CHEMBL233004 | N-(4-(2-(2-fluoro-4-isobutoxyphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(F)c1 |w:17.18| Show InChI InChI=1S/C19H21FN2O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203976
(CHEMBL395345 | N-(4-(2-(2-chloro-4-isobutoxyphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Cl)c1 |w:17.18| Show InChI InChI=1S/C19H21ClN2O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,22,23) | PDB
MMDB
Reactome pathway
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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50195042
(CHEMBL220230 | N-(4-(2-(3-isobutoxyphenoxy)thiazol...)Show InChI InChI=1S/C19H22N2O3S/c1-13(2)12-23-16-6-5-7-17(10-16)24-19-20-11-18(25-19)9-8-14(3)21-15(4)22/h5-7,10-11,13-14H,12H2,1-4H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203975
(CHEMBL233383 | N-(4-(2-(2-chloro-4-propoxyphenoxy)...)Show SMILES CCCOc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Cl)c1 |w:16.17| Show InChI InChI=1S/C18H19ClN2O3S/c1-4-9-23-14-6-8-17(16(19)10-14)24-18-20-11-15(25-18)7-5-12(2)21-13(3)22/h6,8,10-12H,4,9H2,1-3H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50195037
(CHEMBL220668 | N-(4-(2-(4-(cyclohexyloxy)phenoxy)t...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OC3CCCCC3)cc2)s1 Show InChI InChI=1S/C21H24N2O3S/c1-15(23-16(2)24)8-13-20-14-22-21(27-20)26-19-11-9-18(10-12-19)25-17-6-4-3-5-7-17/h9-12,14-15,17H,3-7H2,1-2H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203968
(CHEMBL393254 | N-(4-(2-(3-isobutoxy-2-methylphenox...)Show SMILES CC(C)COc1cccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c1C |w:18.19| Show InChI InChI=1S/C20H24N2O3S/c1-13(2)12-24-18-7-6-8-19(15(18)4)25-20-21-11-17(26-20)10-9-14(3)22-16(5)23/h6-8,11,13-14H,12H2,1-5H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50189630
(CHEMBL377212 | N-(4-(2-(4-isopropoxyphenoxy)thiazo...)Show InChI InChI=1S/C18H20N2O3S/c1-12(2)22-15-6-8-16(9-7-15)23-18-19-11-17(24-18)10-5-13(3)20-14(4)21/h6-9,11-13H,1-4H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50195015
(CHEMBL219948 | N-(4-(2-(4-(cyclohexylmethoxy)pheno...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2)s1 Show InChI InChI=1S/C22H26N2O3S/c1-16(24-17(2)25)8-13-21-14-23-22(28-21)27-20-11-9-19(10-12-20)26-15-18-6-4-3-5-7-18/h9-12,14,16,18H,3-7,15H2,1-2H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203972
(CHEMBL233006 | N-(4-(2-(2-chloro-4-(cyclohexylmeth...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C22H25ClN2O3S/c1-15(25-16(2)26)8-10-19-13-24-22(29-19)28-21-11-9-18(12-20(21)23)27-14-17-6-4-3-5-7-17/h9,11-13,15,17H,3-7,14H2,1-2H3,(H,25,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203979
(CHEMBL393192 | N-(4-(2-(2-chloro-4-(cyclohexyloxy)...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OC3CCCCC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C21H23ClN2O3S/c1-14(24-15(2)25)8-10-18-13-23-21(28-18)27-20-11-9-17(12-19(20)22)26-16-6-4-3-5-7-16/h9,11-14,16H,3-7H2,1-2H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203983
(CHEMBL233005 | N-(4-(2-(2-bromo-4-isobutoxyphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Br)c1 |w:17.18| Show InChI InChI=1S/C19H21BrN2O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,22,23) | PDB
MMDB
Reactome pathway
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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203967
(CHEMBL232002 | N-(4-(2-(2-cyano-4-isobutoxyphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(c1)C#N |w:17.18| Show InChI InChI=1S/C20H21N3O3S/c1-13(2)12-25-17-6-8-19(16(9-17)10-21)26-20-22-11-18(27-20)7-5-14(3)23-15(4)24/h6,8-9,11,13-14H,12H2,1-4H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50195048
(CHEMBL219665 | N-(4-(2-(4-((tetrahydrofuran-3-yl)m...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCOC3)cc2)s1 Show InChI InChI=1S/C20H22N2O4S/c1-14(22-15(2)23)3-8-19-11-21-20(27-19)26-18-6-4-17(5-7-18)25-13-16-9-10-24-12-16/h4-7,11,14,16H,9-10,12-13H2,1-2H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203973
(CHEMBL233392 | N-(4-(2-(2-chloro-4-isopropoxypheno...)Show SMILES CC(C)Oc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Cl)c1 |w:16.17| Show InChI InChI=1S/C18H19ClN2O3S/c1-11(2)23-14-6-8-17(16(19)9-14)24-18-20-10-15(25-18)7-5-12(3)21-13(4)22/h6,8-12H,1-4H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 69 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203984
(CHEMBL232944 | N-(4-(2-(4-isobutoxy-2-nitrophenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(c1)[N+]([O-])=O |w:17.18| Show InChI InChI=1S/C19H21N3O5S/c1-12(2)11-26-15-6-8-18(17(9-15)22(24)25)27-19-20-10-16(28-19)7-5-13(3)21-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,21,23) | PDB
MMDB
Reactome pathway
KEGG
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B.MOAD
DrugBank
antibodypedia
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| 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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50195042
(CHEMBL220230 | N-(4-(2-(3-isobutoxyphenoxy)thiazol...)Show InChI InChI=1S/C19H22N2O3S/c1-13(2)12-23-16-6-5-7-17(10-16)24-19-20-11-18(25-19)9-8-14(3)21-15(4)22/h5-7,10-11,13-14H,12H2,1-4H3,(H,21,22) | PDB
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| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50195015
(CHEMBL219948 | N-(4-(2-(4-(cyclohexylmethoxy)pheno...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2)s1 Show InChI InChI=1S/C22H26N2O3S/c1-16(24-17(2)25)8-13-21-14-23-22(28-21)27-20-11-9-19(10-12-20)26-15-18-6-4-3-5-7-18/h9-12,14,16,18H,3-7,15H2,1-2H3,(H,24,25) | PDB
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| CHEMBL
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PC sid
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PubMed
| n/a | n/a | 86 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50195037
(CHEMBL220668 | N-(4-(2-(4-(cyclohexyloxy)phenoxy)t...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OC3CCCCC3)cc2)s1 Show InChI InChI=1S/C21H24N2O3S/c1-15(23-16(2)24)8-13-20-14-22-21(27-20)26-19-11-9-18(10-12-19)25-17-6-4-3-5-7-17/h9-12,14-15,17H,3-7H2,1-2H3,(H,23,24) | PDB
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PC sid
UniChem
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PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50195026
(CHEMBL223100 | N-(4-(2-(4-propoxyphenoxy)thiazol-5...)Show InChI InChI=1S/C18H20N2O3S/c1-4-11-22-15-6-8-16(9-7-15)23-18-19-12-17(24-18)10-5-13(2)20-14(3)21/h6-9,12-13H,4,11H2,1-3H3,(H,20,21) | PDB
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PC sid
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PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203971
(CHEMBL391303 | N-(4-(2-(2-chloro-4-((tetrahydrofur...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCOC3)cc2Cl)s1 |w:1.0,19.18| Show InChI InChI=1S/C20H21ClN2O4S/c1-13(23-14(2)24)3-5-17-10-22-20(28-17)27-19-6-4-16(9-18(19)21)26-12-15-7-8-25-11-15/h4,6,9-10,13,15H,7-8,11-12H2,1-2H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
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B.MOAD
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50195029
(CHEMBL375532 | N-(4-(2-(4-isobutoxyphenoxy)thiazol...)Show InChI InChI=1S/C19H22N2O3S/c1-13(2)12-23-16-6-8-17(9-7-16)24-19-20-11-18(25-19)10-5-14(3)21-15(4)22/h6-9,11,13-14H,12H2,1-4H3,(H,21,22) | PDB
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| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203980
(CHEMBL234007 | N-(4-(2-(4-isobutoxy-2-vinylphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(C=C)c1 |w:17.18| Show InChI InChI=1S/C21H24N2O3S/c1-6-17-11-18(25-13-14(2)3)8-10-20(17)26-21-22-12-19(27-21)9-7-15(4)23-16(5)24/h6,8,10-12,14-15H,1,13H2,2-5H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
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| CHEMBL
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203969
(CHEMBL233004 | N-(4-(2-(2-fluoro-4-isobutoxyphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(F)c1 |w:17.18| Show InChI InChI=1S/C19H21FN2O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,22,23) | PDB
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PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203965
(CHEMBL232003 | N-(4-(2-(2-formyl-4-isobutoxyphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(C=O)c1 |w:17.18| Show InChI InChI=1S/C20H22N2O4S/c1-13(2)12-25-17-6-8-19(16(9-17)11-23)26-20-21-10-18(27-20)7-5-14(3)22-15(4)24/h6,8-11,13-14H,12H2,1-4H3,(H,22,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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GoogleScholar
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| 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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203974
((Z)-N-(4-(2-(2-((hydroxyimino)methyl)-4-isobutoxyp...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(CN=O)c1 Show InChI InChI=1S/C20H23N3O4S/c1-13(2)12-26-17-6-8-19(16(9-17)10-22-25)27-20-21-11-18(28-20)7-5-14(3)23-15(4)24/h6,8-9,11,13-14H,10,12H2,1-4H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 570 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50195048
(CHEMBL219665 | N-(4-(2-(4-((tetrahydrofuran-3-yl)m...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCOC3)cc2)s1 Show InChI InChI=1S/C20H22N2O4S/c1-14(22-15(2)23)3-8-19-11-21-20(27-19)26-18-6-4-17(5-7-18)25-13-16-9-10-24-12-16/h4-7,11,14,16H,9-10,12-13H2,1-2H3,(H,22,23) | PDB
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PC sid
UniChem
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PubMed
| n/a | n/a | 760 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203981
(CHEMBL376717 | N-(4-(2-(4-(cyclopropylmethoxy)phen...)Show InChI InChI=1S/C19H20N2O3S/c1-13(21-14(2)22)3-10-18-11-20-19(25-18)24-17-8-6-16(7-9-17)23-12-15-4-5-15/h6-9,11,13,15H,4-5,12H2,1-2H3,(H,21,22) | PDB
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PubMed
| n/a | n/a | 940 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203966
(CHEMBL396419 | N-(4-(2-(2-(hydroxymethyl)-4-isobut...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(CO)c1 |w:17.18| Show InChI InChI=1S/C20H24N2O4S/c1-13(2)12-25-17-6-8-19(16(9-17)11-23)26-20-21-10-18(27-20)7-5-14(3)22-15(4)24/h6,8-10,13-14,23H,11-12H2,1-4H3,(H,22,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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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 |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203977
(CHEMBL397164 | N-(4-(2-(2-amino-4-isobutoxyphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(N)c1 |w:17.18| Show InChI InChI=1S/C19H23N3O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11,20H2,1-4H3,(H,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203979
(CHEMBL393192 | N-(4-(2-(2-chloro-4-(cyclohexyloxy)...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OC3CCCCC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C21H23ClN2O3S/c1-14(24-15(2)25)8-10-18-13-23-21(28-18)27-20-11-9-17(12-19(20)22)26-16-6-4-3-5-7-16/h9,11-14,16H,3-7H2,1-2H3,(H,24,25) | PDB
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203965
(CHEMBL232003 | N-(4-(2-(2-formyl-4-isobutoxyphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(C=O)c1 |w:17.18| Show InChI InChI=1S/C20H22N2O4S/c1-13(2)12-25-17-6-8-19(16(9-17)11-23)26-20-21-10-18(27-20)7-5-14(3)22-15(4)24/h6,8-11,13-14H,12H2,1-4H3,(H,22,24) | PDB
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| CHEMBL
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203972
(CHEMBL233006 | N-(4-(2-(2-chloro-4-(cyclohexylmeth...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCCCC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C22H25ClN2O3S/c1-15(25-16(2)26)8-10-19-13-24-22(29-19)28-21-11-9-18(12-20(21)23)27-14-17-6-4-3-5-7-17/h9,11-13,15,17H,3-7,14H2,1-2H3,(H,25,26) | PDB
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PC sid
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Similars
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PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203967
(CHEMBL232002 | N-(4-(2-(2-cyano-4-isobutoxyphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(c1)C#N |w:17.18| Show InChI InChI=1S/C20H21N3O3S/c1-13(2)12-25-17-6-8-19(16(9-17)10-21)26-20-22-11-18(27-20)7-5-14(3)23-15(4)24/h6,8-9,11,13-14H,12H2,1-4H3,(H,23,24) | PDB
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Similars
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PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203964
(CHEMBL391872 | N-(4-(2-(2-((dimethylamino)methyl)-...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(CN(C)C)c1 |w:17.18| Show InChI InChI=1S/C22H29N3O3S/c1-15(2)14-27-19-8-10-21(18(11-19)13-25(5)6)28-22-23-12-20(29-22)9-7-16(3)24-17(4)26/h8,10-12,15-16H,13-14H2,1-6H3,(H,24,26) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50189630
(CHEMBL377212 | N-(4-(2-(4-isopropoxyphenoxy)thiazo...)Show InChI InChI=1S/C18H20N2O3S/c1-12(2)22-15-6-8-16(9-7-15)23-18-19-11-17(24-18)10-5-13(3)20-14(4)21/h6-9,11-13H,1-4H3,(H,20,21) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203982
(CHEMBL428895 | N-{3-[2-(2-acetylamino-4-isobutoxy-...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(NC(C)=O)c1 |w:17.18| Show InChI InChI=1S/C21H25N3O4S/c1-13(2)12-27-17-7-9-20(19(10-17)24-16(5)26)28-21-22-11-18(29-21)8-6-14(3)23-15(4)25/h7,9-11,13-14H,12H2,1-5H3,(H,23,25)(H,24,26) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203978
(CHEMBL233384 | N-(4-(2-(2-chloro-4-(cyclopropylmet...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CC3)cc2Cl)s1 |w:1.0| Show InChI InChI=1S/C19H19ClN2O3S/c1-12(22-13(2)23)3-7-16-10-21-19(26-16)25-18-8-6-15(9-17(18)20)24-11-14-4-5-14/h6,8-10,12,14H,4-5,11H2,1-2H3,(H,22,23) | PDB
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Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203977
(CHEMBL397164 | N-(4-(2-(2-amino-4-isobutoxyphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(N)c1 |w:17.18| Show InChI InChI=1S/C19H23N3O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11,20H2,1-4H3,(H,22,23) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203980
(CHEMBL234007 | N-(4-(2-(4-isobutoxy-2-vinylphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(C=C)c1 |w:17.18| Show InChI InChI=1S/C21H24N2O3S/c1-6-17-11-18(25-13-14(2)3)8-10-20(17)26-21-22-12-19(27-21)9-7-15(4)23-16(5)24/h6,8,10-12,14-15H,1,13H2,2-5H3,(H,23,24) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203984
(CHEMBL232944 | N-(4-(2-(4-isobutoxy-2-nitrophenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(c1)[N+]([O-])=O |w:17.18| Show InChI InChI=1S/C19H21N3O5S/c1-12(2)11-26-15-6-8-18(17(9-15)22(24)25)27-19-20-10-16(28-19)7-5-13(3)21-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,21,23) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203974
((Z)-N-(4-(2-(2-((hydroxyimino)methyl)-4-isobutoxyp...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(CN=O)c1 Show InChI InChI=1S/C20H23N3O4S/c1-13(2)12-26-17-6-8-19(16(9-17)10-22-25)27-20-21-11-18(28-20)7-5-14(3)23-15(4)24/h6,8-9,11,13-14H,10,12H2,1-4H3,(H,23,24) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203975
(CHEMBL233383 | N-(4-(2-(2-chloro-4-propoxyphenoxy)...)Show SMILES CCCOc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Cl)c1 |w:16.17| Show InChI InChI=1S/C18H19ClN2O3S/c1-4-9-23-14-6-8-17(16(19)10-14)24-18-20-11-15(25-18)7-5-12(2)21-13(3)22/h6,8,10-12H,4,9H2,1-3H3,(H,21,22) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203982
(CHEMBL428895 | N-{3-[2-(2-acetylamino-4-isobutoxy-...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(NC(C)=O)c1 |w:17.18| Show InChI InChI=1S/C21H25N3O4S/c1-13(2)12-27-17-7-9-20(19(10-17)24-16(5)26)28-21-22-11-18(29-21)8-6-14(3)23-15(4)25/h7,9-11,13-14H,12H2,1-5H3,(H,23,25)(H,24,26) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203968
(CHEMBL393254 | N-(4-(2-(3-isobutoxy-2-methylphenox...)Show SMILES CC(C)COc1cccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c1C |w:18.19| Show InChI InChI=1S/C20H24N2O3S/c1-13(2)12-24-18-7-6-8-19(15(18)4)25-20-21-11-17(26-20)10-9-14(3)22-16(5)23/h6-8,11,13-14H,12H2,1-5H3,(H,22,23) | PDB
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Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203971
(CHEMBL391303 | N-(4-(2-(2-chloro-4-((tetrahydrofur...)Show SMILES CC(NC(C)=O)C#Cc1cnc(Oc2ccc(OCC3CCOC3)cc2Cl)s1 |w:1.0,19.18| Show InChI InChI=1S/C20H21ClN2O4S/c1-13(23-14(2)24)3-5-17-10-22-20(28-17)27-19-6-4-16(9-18(19)21)26-12-15-7-8-25-11-15/h4,6,9-10,13,15H,7-8,11-12H2,1-2H3,(H,23,24) | PDB
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Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203973
(CHEMBL233392 | N-(4-(2-(2-chloro-4-isopropoxypheno...)Show SMILES CC(C)Oc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Cl)c1 |w:16.17| Show InChI InChI=1S/C18H19ClN2O3S/c1-11(2)23-14-6-8-17(16(19)9-14)24-18-20-10-15(25-18)7-5-12(3)21-13(4)22/h6,8-12H,1-4H3,(H,21,22) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203976
(CHEMBL395345 | N-(4-(2-(2-chloro-4-isobutoxyphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Cl)c1 |w:17.18| Show InChI InChI=1S/C19H21ClN2O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,22,23) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203983
(CHEMBL233005 | N-(4-(2-(2-bromo-4-isobutoxyphenoxy...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(Br)c1 |w:17.18| Show InChI InChI=1S/C19H21BrN2O3S/c1-12(2)11-24-15-6-8-18(17(20)9-15)25-19-21-10-16(26-19)7-5-13(3)22-14(4)23/h6,8-10,12-13H,11H2,1-4H3,(H,22,23) | PDB
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Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203966
(CHEMBL396419 | N-(4-(2-(2-(hydroxymethyl)-4-isobut...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(CO)c1 |w:17.18| Show InChI InChI=1S/C20H24N2O4S/c1-13(2)12-25-17-6-8-19(16(9-17)11-23)26-20-21-10-18(27-20)7-5-14(3)22-15(4)24/h6,8-10,13-14,23H,11-12H2,1-4H3,(H,22,24) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 1
(Homo sapiens (Human)) | BDBM50203970
(CHEMBL232004 | N-(4-(2-(4-isobutoxy-2-methylphenox...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(C)c1 |w:17.18| Show InChI InChI=1S/C20H24N2O3S/c1-13(2)12-24-17-7-9-19(14(3)10-17)25-20-21-11-18(26-20)8-6-15(4)22-16(5)23/h7,9-11,13,15H,12H2,1-5H3,(H,22,23) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC1 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2
(Homo sapiens (Human)) | BDBM50203964
(CHEMBL391872 | N-(4-(2-(2-((dimethylamino)methyl)-...)Show SMILES CC(C)COc1ccc(Oc2ncc(s2)C#CC(C)NC(C)=O)c(CN(C)C)c1 |w:17.18| Show InChI InChI=1S/C22H29N3O3S/c1-15(2)14-27-19-8-10-21(18(11-19)13-25(5)6)28-22-23-12-20(29-22)9-7-16(3)24-17(4)26/h8,10-12,15-16H,13-14H2,1-6H3,(H,24,26) | PDB
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| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant ACC2 |
Bioorg Med Chem Lett 17: 1961-5 (2007)
Article DOI: 10.1016/j.bmcl.2007.01.022
BindingDB Entry DOI: 10.7270/Q2W095KS |
More data for this
Ligand-Target Pair | |
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