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3 similar compounds to monomer 50024524

Compile data set for download or QSAR
Wt: 315.1
BDBM50014324
Wt: 349.6
BDBM50024490
Wt: 343.2
BDBM50024498

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50014324,50024490,50024498   
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)
BDBM50014324
PNG
(5-[Bis-(4-chloro-phenyl)-methyl]-pyrimidine | 5-[B...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H12Cl2N2/c18-15-5-1-12(2-6-15)17(14-9-20-11-21-10-14)13-3-7-16(19)8-4-13/h1-11,17H
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Article
PubMed
29n/an/an/an/an/an/an/an/a



Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity for Cytochrome P450 19A1


J Med Chem 33: 2933-42 (1990)


Article DOI: 10.1021/jm00173a001
BindingDB Entry DOI: 10.7270/Q2VM4CW9
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50014324
PNG
(5-[Bis-(4-chloro-phenyl)-methyl]-pyrimidine | 5-[B...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H12Cl2N2/c18-15-5-1-12(2-6-15)17(14-9-20-11-21-10-14)13-3-7-16(19)8-4-13/h1-11,17H
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n/an/an/an/a 55n/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)
BDBM50014324
PNG
(5-[Bis-(4-chloro-phenyl)-methyl]-pyrimidine | 5-[B...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H12Cl2N2/c18-15-5-1-12(2-6-15)17(14-9-20-11-21-10-14)13-3-7-16(19)8-4-13/h1-11,17H
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n/an/an/an/a 55n/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsome


J Med Chem 33: 416-29 (1990)


Article DOI: 10.1021/jm00163a065
BindingDB Entry DOI: 10.7270/Q2WM1F0N
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Rattus norvegicus)
BDBM50024490
PNG
(5-[Chloro-bis-(4-chloro-phenyl)-methyl]-pyrimidine...)
Show SMILES Clc1ccc(cc1)C(Cl)(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H11Cl3N2/c18-15-5-1-12(2-6-15)17(20,14-9-21-11-22-10-14)13-3-7-16(19)8-4-13/h1-11H
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PubMed
n/an/an/an/a 275n/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)
BDBM50024498
PNG
(5-[1,1-Bis-(4-chloro-phenyl)-propyl]-pyrimidine | ...)
Show SMILES CCC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C19H16Cl2N2/c1-2-19(16-11-22-13-23-12-16,14-3-7-17(20)8-4-14)15-5-9-18(21)10-6-15/h3-13H,2H2,1H3
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PubMed
n/an/an/an/a 2.95E+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