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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Egl nine homolog 1' and Ligand = 'BDBM50318679'   
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
Egl nine homolog 1


(Homo sapiens (Human))
BDBM50318679
PNG
(CHEMBL4162752 | US10889546, Example 44)
Show SMILES OC(=O)CNC(=O)c1ncc(cc1O)C#CCOc1ccc(Cl)cc1
Show InChI InChI=1S/C17H13ClN2O5/c18-12-3-5-13(6-4-12)25-7-1-2-11-8-14(21)16(19-9-11)17(24)20-10-15(22)23/h3-6,8-9,21H,7,10H2,(H,20,24)(H,22,23)
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US Patent
n/an/a 13.7n/an/an/an/an/an/a



Jiangsu Hengrui Medicine Co., Ltd.

US Patent


Assay Description
The EGLN-1 (or EGLN-3) enzyme activity is determined using mass spectrometry (matrix-assisted laser desorption ionization, time-of-flight MS, MALD...


US Patent US10889546 (2021)


BindingDB Entry DOI: 10.7270/Q21839MM
More data for this
Ligand-Target Pair
Egl nine homolog 1


(Homo sapiens (Human))
BDBM50318679
PNG
(CHEMBL4162752 | US10889546, Example 44)
Show SMILES OC(=O)CNC(=O)c1ncc(cc1O)C#CCOc1ccc(Cl)cc1
Show InChI InChI=1S/C17H13ClN2O5/c18-12-3-5-13(6-4-12)25-7-1-2-11-8-14(21)16(19-9-11)17(24)20-10-15(22)23/h3-6,8-9,21H,7,10H2,(H,20,24)(H,22,23)
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Article
PubMed
n/an/a 64n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of FITC-HIF1alpha (556 to 574 residues) binding to PHD2 (181 to 426 residues) (unknown origin) by fluorescence polarization assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01161
BindingDB Entry DOI: 10.7270/Q2280C7P
More data for this
Ligand-Target Pair
Egl nine homolog 1


(Homo sapiens (Human))
BDBM50318679
PNG
(CHEMBL4162752 | US10889546, Example 44)
Show SMILES OC(=O)CNC(=O)c1ncc(cc1O)C#CCOc1ccc(Cl)cc1
Show InChI InChI=1S/C17H13ClN2O5/c18-12-3-5-13(6-4-12)25-7-1-2-11-8-14(21)16(19-9-11)17(24)20-10-15(22)23/h3-6,8-9,21H,7,10H2,(H,20,24)(H,22,23)
PDB
MMDB

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UniChem

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Article
PubMed
n/an/a 1.37E+4n/an/an/an/an/an/a



Cadila Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of HIF-PHD2 (unknown origin) expressed in insect Hi5 cells using peptide as substrate


J Med Chem 61: 6964-6982 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01686
BindingDB Entry DOI: 10.7270/Q2H70JC7
More data for this
Ligand-Target Pair