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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 19A1' and Ligand = 'BDBM50025153'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50025153
PNG
(3-(4-Amino-phenyl)-1,3-dimethyl-pyrrolidine-2,5-di...)
Show SMILES CN1C(=O)CC(C)(C1=O)c1ccc(N)cc1
Show InChI InChI=1S/C12H14N2O2/c1-12(7-10(15)14(2)11(12)16)8-3-5-9(13)6-4-8/h3-6H,7,13H2,1-2H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
1.75E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Cytochrome P450 19A1 against testosterone at 1.5 microM (Km=0.13 uM)


J Med Chem 29: 520-3 (1986)


BindingDB Entry DOI: 10.7270/Q28051MG
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50025153
PNG
(3-(4-Amino-phenyl)-1,3-dimethyl-pyrrolidine-2,5-di...)
Show SMILES CN1C(=O)CC(C)(C1=O)c1ccc(N)cc1
Show InChI InChI=1S/C12H14N2O2/c1-12(7-10(15)14(2)11(12)16)8-3-5-9(13)6-4-8/h3-6H,7,13H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 1.57E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Cytochrome P450 19A1 against testosterone at 1.5 microM (Km=0.13 uM)


J Med Chem 29: 520-3 (1986)


BindingDB Entry DOI: 10.7270/Q28051MG
More data for this
Ligand-Target Pair