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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 = 'BDBM141557'   
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))
BDBM141557
PNG
(US8921389, 13 | US9695170 16)
Show SMILES OC(=O)CNC(=O)c1nc(-c2ccccc2)c2n(Cc3ccccc3)c(=O)c(cc2c1O)-c1ccccc1
Show InChI InChI=1S/C30H23N3O5/c34-24(35)17-31-29(37)26-28(36)23-16-22(20-12-6-2-7-13-20)30(38)33(18-19-10-4-1-5-11-19)27(23)25(32-26)21-14-8-3-9-15-21/h1-16,36H,17-18H2,(H,31,37)(H,34,35)
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PC sid
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Similars

US Patent
n/an/a 210n/an/an/an/a7.4n/a



FibroGen, Inc.

US Patent


Assay Description
Ketoglutaric acid α-[1-14C]-sodium salt, alpha-ketoglutaric acid sodium salt, and HPLC purified peptide may be obtained from commercial sources...


US Patent US9695170 (2017)


BindingDB Entry DOI: 10.7270/Q2P55KN0
More data for this
Ligand-Target Pair
Egl nine homolog 1


(Homo sapiens (Human))
BDBM141557
PNG
(US8921389, 13 | US9695170 16)
Show SMILES OC(=O)CNC(=O)c1nc(-c2ccccc2)c2n(Cc3ccccc3)c(=O)c(cc2c1O)-c1ccccc1
Show InChI InChI=1S/C30H23N3O5/c34-24(35)17-31-29(37)26-28(36)23-16-22(20-12-6-2-7-13-20)30(38)33(18-19-10-4-1-5-11-19)27(23)25(32-26)21-14-8-3-9-15-21/h1-16,36H,17-18H2,(H,31,37)(H,34,35)
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PC cid
PC sid
UniChem

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US Patent
n/an/a 300n/an/an/an/a7.4n/a



Fibrogen, Inc.

US Patent


Assay Description
Ketoglutaric acid alpha -[1-14C]-sodium salt, alpha-ketoglutaric acid sodium salt, and HPLC purified peptide may be obtained from commercial sources,...


US Patent US8921389 (2014)


BindingDB Entry DOI: 10.7270/Q20G3HV0
More data for this
Ligand-Target Pair
Egl nine homolog 1


(Homo sapiens (Human))
BDBM141557
PNG
(US8921389, 13 | US9695170 16)
Show SMILES OC(=O)CNC(=O)c1nc(-c2ccccc2)c2n(Cc3ccccc3)c(=O)c(cc2c1O)-c1ccccc1
Show InChI InChI=1S/C30H23N3O5/c34-24(35)17-31-29(37)26-28(36)23-16-22(20-12-6-2-7-13-20)30(38)33(18-19-10-4-1-5-11-19)27(23)25(32-26)21-14-8-3-9-15-21/h1-16,36H,17-18H2,(H,31,37)(H,34,35)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 300n/an/an/an/a7.4n/a



FibroGen, Inc.

US Patent


Assay Description
Ketoglutaric acid α-[1-14C]-sodium salt, alpha-ketoglutaric acid sodium salt, and HPLC purified peptide may be obtained from commercial sources...


US Patent US9695170 (2017)


BindingDB Entry DOI: 10.7270/Q2P55KN0
More data for this
Ligand-Target Pair