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23 similar compounds to monomer 50050356

Compile data set for download or QSAR
Wt: 446.6
BDBM50050352
Wt: 428.6
BDBM50050354
Wt: 413.6
BDBM50050357
Wt: 427.6
BDBM50050358
Wt: 407.5
BDBM50050359
Wt: 444.0
BDBM50050360
Wt: 458.0
BDBM50050361
Wt: 472.0
BDBM50050363
Wt: 435.6
BDBM50050365
Wt: 451.6
BDBM50050366
Wt: 415.6
BDBM50050367
Wt: 462.1
BDBM50050368
Wt: 423.5
BDBM50050370
Wt: 423.5
BDBM50050371
Wt: 429.6
BDBM50050372
Displayed 1 to 15 (of 23 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50050352,50050354,50050357,50050358,50050359,50050360,50050361,50050363,50050365,50050366,50050367,50050368,50050370,50050371,50050372   
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
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050358
PNG
(1-Decyl-cyclopentanecarboxylic acid (2,2,4,6-tetra...)
Show SMILES CCCCCCCCCCC1(CCCC1)C(=O)Nc1c2OC(C)(C)Cc2c(C)cc1C
Show InChI InChI=1S/C28H45NO2/c1-6-7-8-9-10-11-12-13-16-28(17-14-15-18-28)26(30)29-24-22(3)19-21(2)23-20-27(4,5)31-25(23)24/h19H,6-18,20H2,1-5H3,(H,29,30)
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n/an/a 170n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050371
PNG
(2,2-Dimethyl-7-phenoxy-heptanoic acid (2,2,4,6-tet...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCCOc2ccccc2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C27H37NO3/c1-19-17-20(2)23(24-22(19)18-27(5,6)31-24)28-25(29)26(3,4)15-11-8-12-16-30-21-13-9-7-10-14-21/h7,9-10,13-14,17H,8,11-12,15-16,18H2,1-6H3,(H,28,29)
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n/an/a 86n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050367
PNG
(CHEMBL23476 | Hexadecanoic acid (2,2,6-trimethyl-2...)
Show SMILES CCCCCCCCCCCCCCCC(=O)Nc1c2OC(C)(C)Cc2ccc1C
Show InChI InChI=1S/C27H45NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(29)28-25-22(2)19-20-23-21-27(3,4)30-26(23)25/h19-20H,5-18,21H2,1-4H3,(H,28,29)
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n/an/a 24n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050357
PNG
(1-Decyl-cyclopentanecarboxylic acid (2,2,6-trimeth...)
Show SMILES CCCCCCCCCCC1(CCCC1)C(=O)Nc1c2OC(C)(C)Cc2ccc1C
Show InChI InChI=1S/C27H43NO2/c1-5-6-7-8-9-10-11-12-17-27(18-13-14-19-27)25(29)28-23-21(2)15-16-22-20-26(3,4)30-24(22)23/h15-16H,5-14,17-20H2,1-4H3,(H,28,29)
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n/an/a 240n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050363
PNG
(8-(4-Chloro-phenoxy)-2,2-dimethyl-octanoic acid (2...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCCCOc2ccc(Cl)cc2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C28H38ClNO3/c1-19-17-20(2)24(25-23(19)18-28(5,6)33-25)30-26(31)27(3,4)15-9-7-8-10-16-32-22-13-11-21(29)12-14-22/h11-14,17H,7-10,15-16,18H2,1-6H3,(H,30,31)
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n/an/a 76n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050361
PNG
(7-(4-Chloro-phenoxy)-2,2-dimethyl-heptanoic acid (...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCCOc2ccc(Cl)cc2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C27H36ClNO3/c1-18-16-19(2)23(24-22(18)17-27(5,6)32-24)29-25(30)26(3,4)14-8-7-9-15-31-21-12-10-20(28)11-13-21/h10-13,16H,7-9,14-15,17H2,1-6H3,(H,29,30)
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n/an/a 150n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050359
PNG
(2,2-Dimethyl-7-phenyl-heptanoic acid (2,2,4,6-tetr...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCCc2ccccc2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C27H37NO2/c1-19-17-20(2)23(24-22(19)18-27(5,6)30-24)28-25(29)26(3,4)16-12-8-11-15-21-13-9-7-10-14-21/h7,9-10,13-14,17H,8,11-12,15-16,18H2,1-6H3,(H,28,29)
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n/an/a 120n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050366
PNG
(2,2-Dimethyl-8-p-tolyloxy-octanoic acid (2,2,4,6-t...)
Show SMILES Cc1ccc(OCCCCCCC(C)(C)C(=O)Nc2c3OC(C)(C)Cc3c(C)cc2C)cc1
Show InChI InChI=1S/C29H41NO3/c1-20-12-14-23(15-13-20)32-17-11-9-8-10-16-28(4,5)27(31)30-25-22(3)18-21(2)24-19-29(6,7)33-26(24)25/h12-15,18H,8-11,16-17,19H2,1-7H3,(H,30,31)
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n/an/a 50n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050368
PNG
(1-Decyl-cyclopentanecarboxylic acid (5-chloro-2,2,...)
Show SMILES CCCCCCCCCCC1(CCCC1)C(=O)Nc1c2OC(C)(C)Cc2c(C)c(Cl)c1C
Show InChI InChI=1S/C28H44ClNO2/c1-6-7-8-9-10-11-12-13-16-28(17-14-15-18-28)26(31)30-24-21(3)23(29)20(2)22-19-27(4,5)32-25(22)24/h6-19H2,1-5H3,(H,30,31)
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n/an/a 290n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050365
PNG
(5-(4-Isobutyl-phenyl)-2,2-dimethyl-pentanoic acid ...)
Show SMILES CC(C)Cc1ccc(CCCC(C)(C)C(=O)Nc2c3OC(C)(C)Cc3c(C)cc2C)cc1
Show InChI InChI=1S/C29H41NO2/c1-19(2)16-23-13-11-22(12-14-23)10-9-15-28(5,6)27(31)30-25-21(4)17-20(3)24-18-29(7,8)32-26(24)25/h11-14,17,19H,9-10,15-16,18H2,1-8H3,(H,30,31)
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n/an/a 40n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050372
PNG
(2,2-Dimethyl-tetradecanoic acid (2,2,4,6-tetrameth...)
Show SMILES CCCCCCCCCCCCC(C)(C)C(=O)Nc1c2OC(C)(C)Cc2c(C)cc1C
Show InChI InChI=1S/C28H47NO2/c1-8-9-10-11-12-13-14-15-16-17-18-27(4,5)26(30)29-24-22(3)19-21(2)23-20-28(6,7)31-25(23)24/h19H,8-18,20H2,1-7H3,(H,29,30)
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n/an/a 33n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050360
PNG
(6-(4-Chloro-phenoxy)-2,2-dimethyl-hexanoic acid (2...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCOc2ccc(Cl)cc2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C26H34ClNO3/c1-17-15-18(2)22(23-21(17)16-26(5,6)31-23)28-24(29)25(3,4)13-7-8-14-30-20-11-9-19(27)10-12-20/h9-12,15H,7-8,13-14,16H2,1-6H3,(H,28,29)
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n/an/a 330n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050370
PNG
(6-Benzyloxy-2,2-dimethyl-hexanoic acid (2,2,4,6-te...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCOCc2ccccc2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C27H37NO3/c1-19-16-20(2)23(24-22(19)17-27(5,6)31-24)28-25(29)26(3,4)14-10-11-15-30-18-21-12-8-7-9-13-21/h7-9,12-13,16H,10-11,14-15,17-18H2,1-6H3,(H,28,29)
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n/an/a 400n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050354
PNG
(2,2-Dimethyl-8-piperidin-1-yl-octanoic acid (2,2,4...)
Show SMILES Cc1cc(C)c(NC(=O)C(C)(C)CCCCCCN2CCCCC2)c2OC(C)(C)Cc12
Show InChI InChI=1S/C27H44N2O2/c1-20-18-21(2)23(24-22(20)19-27(5,6)31-24)28-25(30)26(3,4)14-10-7-8-11-15-29-16-12-9-13-17-29/h18H,7-17,19H2,1-6H3,(H,28,30)
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n/an/a>500n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair
Acyl-CoA:cholesterol acyltransferase


(Oryctolagus cuniculus)
BDBM50050352
PNG
(2,2-Dimethyl-dodecanoic acid (2,2,4,6-tetramethyl-...)
Show SMILES CCCCCCCCCCC(C)(C)C(=O)Nc1c2OC(C)(C)Cc2c(C)c(c1C)[N+]([O-])=O
Show InChI InChI=1S/C26H42N2O4/c1-8-9-10-11-12-13-14-15-16-25(4,5)24(29)27-21-19(3)22(28(30)31)18(2)20-17-26(6,7)32-23(20)21/h8-17H2,1-7H3,(H,27,29)
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n/an/a 36n/an/an/an/an/an/a



Institute for Bio-Medical Research

Curated by ChEMBL


Assay Description
Inhibitory activity against Acyl coenzyme A:cholesterol acyltransferase 1 obtained from rabbit intestine microsomes


J Med Chem 39: 1262-70 (1996)


Article DOI: 10.1021/jm950828+
BindingDB Entry DOI: 10.7270/Q24T6HGW
More data for this
Ligand-Target Pair