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59 similar compounds to monomer 131167

Compile data set for download or QSAR
Wt: 375.5
BDBM131608
Wt: 349.4
BDBM131162
Wt: 373.4
BDBM131620
Wt: 359.4
BDBM131621
Wt: 375.5
BDBM131622
Wt: 389.5
BDBM131624
Wt: 363.4
BDBM131341
Wt: 348.4
BDBM131343
Wt: 361.4
BDBM131344
Wt: 377.4
BDBM131345
Wt: 365.4
BDBM131346
Wt: 321.4
BDBM131628
Wt: 361.4
BDBM131631
Wt: 361.4
BDBM131632
Wt: 365.4
BDBM131352
Displayed 1 to 15 (of 59 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 131608,131162,131620,131621,131622,131624,131341,131343,131344,131345,131346,131628,131631,131632,131352   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131162
PNG
(US8835472, 2.95)
Show SMILES CCCOc1ccc(C#Cc2ccc(CC(C)NC(C)=O)cc2)c(C)c1
Show InChI InChI=1/C23H27NO2/c1-5-14-26-23-13-12-22(17(2)15-23)11-10-20-6-8-21(9-7-20)16-18(3)24-19(4)25/h6-9,12-13,15,18H,5,14,16H2,1-4H3,(H,24,25)
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n/an/a 110n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131632
PNG
(US8835472, 14.41)
Show SMILES CC(C)Oc1ccc(cc1)C#Cc1ccc(CC(C)NC(=O)C2CC2)cc1
Show InChI InChI=1/C24H27NO2/c1-17(2)27-23-14-10-20(11-15-23)5-4-19-6-8-21(9-7-19)16-18(3)25-24(26)22-12-13-22/h6-11,14-15,17-18,22H,12-13,16H2,1-3H3,(H,25,26)
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n/an/a 440n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131343
PNG
(US8835472, 9.10)
Show SMILES CC(Cc1ccc(cc1)C#Cc1ccc(OC2CNC2)cc1)NC(C)=O
Show InChI InChI=1/C22H24N2O2/c1-16(24-17(2)25)13-20-7-5-18(6-8-20)3-4-19-9-11-21(12-10-19)26-22-14-23-15-22/h5-12,16,22-23H,13-15H2,1-2H3,(H,24,25)
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n/an/a 1.22E+4n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131344
PNG
(US8835472, 9.11)
Show SMILES CC(Cc1ccc(cc1)C#Cc1ccc(OCC2(C)CC2)cc1)NC(C)=O
Show InChI InChI=1/C24H27NO2/c1-18(25-19(2)26)16-22-8-6-20(7-9-22)4-5-21-10-12-23(13-11-21)27-17-24(3)14-15-24/h6-13,18H,14-17H2,1-3H3,(H,25,26)
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n/an/a 180n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131345
PNG
(US8835472, 9.12)
Show SMILES CC(Cc1ccc(cc1)C#Cc1ccc(OC2CCOCC2)cc1)NC(C)=O
Show InChI InChI=1/C24H27NO3/c1-18(25-19(2)26)17-22-7-5-20(6-8-22)3-4-21-9-11-23(12-10-21)28-24-13-15-27-16-14-24/h5-12,18,24H,13-17H2,1-2H3,(H,25,26)
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n/an/a 160n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131346
PNG
(US8835472, 9.13)
Show SMILES COCCCOc1cccc(c1)C#Cc1ccc(CC(C)NC(C)=O)cc1
Show InChI InChI=1/C23H27NO3/c1-18(24-19(2)25)16-22-12-9-20(10-13-22)8-11-21-6-4-7-23(17-21)27-15-5-14-26-3/h4,6-7,9-10,12-13,17-18H,5,14-16H2,1-3H3,(H,24,25)
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n/an/a 630n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131352
PNG
(US8835472, 9.19)
Show SMILES CCOCCOc1ccc(cc1)C#Cc1ccc(CC(C)NC(C)=O)cc1
Show InChI InChI=1/C23H27NO3/c1-4-26-15-16-27-23-13-11-21(12-14-23)6-5-20-7-9-22(10-8-20)17-18(2)24-19(3)25/h7-14,18H,4,15-17H2,1-3H3,(H,24,25)
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n/an/a 280n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131608
PNG
(US8835472, 14.17)
Show SMILES CC(C)COc1ccc(cc1)C#Cc1ccc(CC(C)NC(=O)C2CC2)cc1
Show InChI InChI=1/C25H29NO2/c1-18(2)17-28-24-14-10-21(11-15-24)5-4-20-6-8-22(9-7-20)16-19(3)26-25(27)23-12-13-23/h6-11,14-15,18-19,23H,12-13,16-17H2,1-3H3,(H,26,27)
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n/an/a 510n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131624
PNG
(US8835472, 14.33)
Show SMILES CCC(CC)Oc1ccc(cc1)C#Cc1ccc(CC(C)NC(=O)C2CC2)cc1
Show InChI InChI=1/C26H31NO2/c1-4-24(5-2)29-25-16-12-21(13-17-25)7-6-20-8-10-22(11-9-20)18-19(3)27-26(28)23-14-15-23/h8-13,16-17,19,23-24H,4-5,14-15,18H2,1-3H3,(H,27,28)
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n/an/a 1.60E+3n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131620
PNG
(US8835472, 14.29)
Show SMILES CC(Cc1ccc(cc1)C#Cc1ccc(OC2CCC2)cc1)NC(=O)C1CC1
Show InChI InChI=1/C25H27NO2/c1-18(26-25(27)22-13-14-22)17-21-9-7-19(8-10-21)5-6-20-11-15-24(16-12-20)28-23-3-2-4-23/h7-12,15-16,18,22-23H,2-4,13-14,17H2,1H3,(H,26,27)
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n/an/a 680n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131621
PNG
(US8835472, 14.30)
Show SMILES CC(Cc1ccc(cc1)C#Cc1ccc(OC2CC2)cc1)NC(=O)C1CC1
Show InChI InChI=1/C24H25NO2/c1-17(25-24(26)21-10-11-21)16-20-6-4-18(5-7-20)2-3-19-8-12-22(13-9-19)27-23-14-15-23/h4-9,12-13,17,21,23H,10-11,14-16H2,1H3,(H,25,26)
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n/an/a 150n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131622
PNG
(US8835472, 14.31)
Show SMILES CCCCOc1ccc(cc1)C#Cc1ccc(CC(C)NC(=O)C2CC2)cc1
Show InChI InChI=1/C25H29NO2/c1-3-4-17-28-24-15-11-21(12-16-24)6-5-20-7-9-22(10-8-20)18-19(2)26-25(27)23-13-14-23/h7-12,15-16,19,23H,3-4,13-14,17-18H2,1-2H3,(H,26,27)
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n/an/a 90n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131628
PNG
(US8835472, 14.37)
Show SMILES CCCOc1ccc(cc1)C#Cc1ccc(CCNC(C)=O)cc1
Show InChI InChI=1S/C21H23NO2/c1-3-16-24-21-12-10-19(11-13-21)5-4-18-6-8-20(9-7-18)14-15-22-17(2)23/h6-13H,3,14-16H2,1-2H3,(H,22,23)
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n/an/a 170n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131631
PNG
(US8835472, 14.40)
Show SMILES CCCOc1ccc(cc1)C#Cc1ccc(CC(C)NC(=O)C2CC2)cc1
Show InChI InChI=1/C24H27NO2/c1-3-16-27-23-14-10-20(11-15-23)5-4-19-6-8-21(9-7-19)17-18(2)25-24(26)22-12-13-22/h6-11,14-15,18,22H,3,12-13,16-17H2,1-2H3,(H,25,26)
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n/an/a 80n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131341
PNG
(US8835472, 9.8)
Show SMILES CCC(CC)Oc1cccc(c1)C#Cc1ccc(CC(C)NC(C)=O)cc1
Show InChI InChI=1/C24H29NO2/c1-5-23(6-2)27-24-9-7-8-21(17-24)13-10-20-11-14-22(15-12-20)16-18(3)25-19(4)26/h7-9,11-12,14-15,17-18,23H,5-6,16H2,1-4H3,(H,25,26)
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n/an/a 810n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...


US Patent US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair