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BDBM50507428 CHEMBL4567141

SMILES: OC(=O)CNC(=O)c1c(O)c2COCc2n(Cc2cnc(cn2)C(F)(F)F)c1=O

InChI Key: InChIKey=JDLGXHQNBSGCLL-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50507428   
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
Egl nine homolog 1


(Homo sapiens (Human))
BDBM50507428
PNG
(CHEMBL4567141)
Show SMILES OC(=O)CNC(=O)c1c(O)c2COCc2n(Cc2cnc(cn2)C(F)(F)F)c1=O
Show InChI InChI=1S/C16H13F3N4O6/c17-16(18,19)10-2-20-7(1-21-10)4-23-9-6-29-5-8(9)13(26)12(15(23)28)14(27)22-3-11(24)25/h1-2,26H,3-6H2,(H,22,27)(H,24,25)
PDB
MMDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.90n/an/an/an/an/an/a



Merck & Co., Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human HIF-PHD2 expressed in baculovirus-infected Sf9 cells using biotin labelled DLDLEMLAPYIPMDDDFQL and 2-oxoglutarate as ...


ACS Med Chem Lett 9: 1193-1198 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00274
More data for this
Ligand-Target Pair
Prolyl hydroxylase EGLN3


(Homo sapiens (Human))
BDBM50507428
PNG
(CHEMBL4567141)
Show SMILES OC(=O)CNC(=O)c1c(O)c2COCc2n(Cc2cnc(cn2)C(F)(F)F)c1=O
Show InChI InChI=1S/C16H13F3N4O6/c17-16(18,19)10-2-20-7(1-21-10)4-23-9-6-29-5-8(9)13(26)12(15(23)28)14(27)22-3-11(24)25/h1-2,26H,3-6H2,(H,22,27)(H,24,25)
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UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Merck & Co., Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human HIF-PHD3 expressed in baculovirus-infected Sf9 cells using biotin labelled DLDLEMLAPYIPMDDDFQL and 2-oxoglutarate as ...


ACS Med Chem Lett 9: 1193-1198 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00274
More data for this
Ligand-Target Pair
Hypoxia-inducible factor prolyl hydroxylase


(Homo sapiens (Human))
BDBM50507428
PNG
(CHEMBL4567141)
Show SMILES OC(=O)CNC(=O)c1c(O)c2COCc2n(Cc2cnc(cn2)C(F)(F)F)c1=O
Show InChI InChI=1S/C16H13F3N4O6/c17-16(18,19)10-2-20-7(1-21-10)4-23-9-6-29-5-8(9)13(26)12(15(23)28)14(27)22-3-11(24)25/h1-2,26H,3-6H2,(H,22,27)(H,24,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.90n/an/an/an/an/an/a



Merck & Co., Inc.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human HIF-PHD1 expressed in baculovirus-infected Sf9 cells using biotin labelled DLDLEMLAPYIPMDDDFQL and 2-oxoglutarate as ...


ACS Med Chem Lett 9: 1193-1198 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00274
More data for this
Ligand-Target Pair