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PDB code 5O43

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
17-beta-hydroxysteroid dehydrogenase 14

  (270/270 = 100%)
(Homo sapiens (Human))
BDBM50422426
PNG
(CHEMBL4169325)
Show SMILES CN(c1ccc(F)c(O)c1)c1cccc(n1)-c1cccc(O)c1F
Show InChI InChI=1S/C48H84N6O4/c1-3-25-47(56)54-45(40-42-28-30-44(55)31-29-42)48(57)53-39-24-38-51-36-22-13-12-20-34-49-32-18-10-8-6-4-5-7-9-11-19-33-50-35-21-14-15-23-37-52-41-43-26-16-17-27-46(43)58-2/h16-17,26-31,45,49-52,55H,3-15,18-25,32-41H2,1-2H3,(H,53,57)(H,54,56)/t45-/m1/s1
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Similars

PDB
Article
PubMed
42n/an/an/an/an/an/an/an/a



Philipps University Marburg

Curated by ChEMBL


Assay Description
Binding affinity to recombinant 17beta-HSD14 (unknown origin) expressed in Escherichia coli BL21 pLysS strain using E2 as substrate in presence of NA...


Eur J Med Chem 155: 61-76 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.029
BindingDB Entry DOI: 10.7270/Q23F4S76
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output