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9 similar compounds to monomer 50014815

Compile data set for download or QSAR
Wt: 331.1
BDBM50024519
Wt: 314.7
BDBM50024522
Wt: 331.1
BDBM50024480
Wt: 364.7
BDBM50024481
Wt: 262.7
BDBM50024487
Wt: 262.3
BDBM50024492
Wt: 296.7
BDBM50024506
Wt: 331.1
BDBM50024511
Purchase
Wt: 331.1
BDBM50375306

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50024519,50024522,50024480,50024481,50024487,50024492,50024506,50024511,50375306   
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
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024480
PNG
((3,4-Dichloro-phenyl)-phenyl-pyrimidin-5-yl-methan...)
Show SMILES OC(c1ccccc1)(c1ccc(Cl)c(Cl)c1)c1cncnc1
Show InChI InChI=1S/C17H12Cl2N2O/c18-15-7-6-13(8-16(15)19)17(22,12-4-2-1-3-5-12)14-9-20-11-21-10-14/h1-11,22H
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n/an/an/an/a 1.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024481
PNG
((4-Chloro-phenyl)-pyrimidin-5-yl-(4-trifluoromethy...)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(cc1)C(F)(F)F)c1cncnc1
Show InChI InChI=1S/C18H12ClF3N2O/c19-16-7-5-13(6-8-16)17(25,15-9-23-11-24-10-15)12-1-3-14(4-2-12)18(20,21)22/h1-11,25H
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n/an/an/an/a 66n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024487
PNG
(1-(4-Chloro-phenyl)-2-methyl-1-pyrimidin-5-yl-prop...)
Show SMILES CC(C)C(O)(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C14H15ClN2O/c1-10(2)14(18,12-7-16-9-17-8-12)11-3-5-13(15)6-4-11/h3-10,18H,1-2H3
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n/an/an/an/a>2.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024492
PNG
(CHEMBL29670 | Diphenyl-pyrimidin-5-yl-methanol)
Show SMILES OC(c1ccccc1)(c1ccccc1)c1cncnc1
Show InChI InChI=1S/C17H14N2O/c20-17(14-7-3-1-4-8-14,15-9-5-2-6-10-15)16-11-18-13-19-12-16/h1-13,20H
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n/an/an/an/a>2.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Sterol 14α-demethylase (CYP51)


(Homo sapiens (Human))
BDBM50375306
PNG
(TRIARIMOL)
Show SMILES OC(c1ccccc1)(c1cncnc1)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C17H12Cl2N2O/c18-14-6-7-15(16(19)8-14)17(22,12-4-2-1-3-5-12)13-9-20-11-21-10-13/h1-11,22H
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n/an/a>1.00E+4n/an/an/an/an/an/a



ACT LLC

Curated by ChEMBL


Assay Description
Inhibition of human CYP51 expressed in Topp 3 cells by lanosterol demethylase assay


Drug Metab Dispos 35: 493-500 (2007)


Article DOI: 10.1124/dmd.106.013888
BindingDB Entry DOI: 10.7270/Q2DF6S2H
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024511
PNG
((4-Chloro-phenyl)-(2-chloro-phenyl)-pyrimidin-5-yl...)
Show SMILES OC(c1ccc(Cl)cc1)(c1cncnc1)c1ccccc1Cl
Show InChI InChI=1S/C17H12Cl2N2O/c18-14-7-5-12(6-8-14)17(22,13-9-20-11-21-10-13)15-3-1-2-4-16(15)19/h1-11,22H
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n/an/an/an/a 4.10E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024519
PNG
((4-Chloro-phenyl)-(3-chloro-phenyl)-pyrimidin-5-yl...)
Show SMILES OC(c1ccc(Cl)cc1)(c1cccc(Cl)c1)c1cncnc1
Show InChI InChI=1S/C17H12Cl2N2O/c18-15-6-4-12(5-7-15)17(22,14-9-20-11-21-10-14)13-2-1-3-16(19)8-13/h1-11,22H
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n/an/an/an/a 350n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024522
PNG
((4-Chloro-phenyl)-(4-fluoro-phenyl)-pyrimidin-5-yl...)
Show SMILES OC(c1ccc(F)cc1)(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H12ClFN2O/c18-15-5-1-12(2-6-15)17(22,14-9-20-11-21-10-14)13-3-7-16(19)8-4-13/h1-11,22H
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n/an/an/an/a 180n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024506
PNG
((4-Chloro-phenyl)-phenyl-pyrimidin-5-yl-methanol |...)
Show SMILES OC(c1ccccc1)(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H13ClN2O/c18-16-8-6-14(7-9-16)17(21,13-4-2-1-3-5-13)15-10-19-12-20-11-15/h1-12,21H
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n/an/an/an/a>2.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of cytochrome P450 19A1 by rat ovarian microsomes incubated with [3H]androstenedione and NADPH-generating system.


J Med Chem 30: 1359-65 (1987)


Article DOI: 10.1021/jm00391a016
BindingDB Entry DOI: 10.7270/Q2NP251P
More data for this
Ligand-Target Pair