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SMILES: COC(=O)CCc1nc(no1)C1CC(=NO1)c1ccc(O)c(F)c1

InChI Key: InChIKey=QVOODYQAHMMUQF-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50298011   
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
Macrophage migration inhibitory factor


(Homo sapiens (Human))
BDBM50298011
PNG
(CHEMBL563301 | methyl 3-(3-(3(3-fluoro-4hydroxyphe...)
Show SMILES COC(=O)CCc1nc(no1)C1CC(=NO1)c1ccc(O)c(F)c1 |c:14|
Show InChI InChI=1S/C15H14FN3O5/c1-22-14(21)5-4-13-17-15(19-24-13)12-7-10(18-23-12)8-2-3-11(20)9(16)6-8/h2-3,6,12,20H,4-5,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of dopachrome tautomerase activity of human recombinant MIF


Bioorg Med Chem Lett 19: 4773-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.052
BindingDB Entry DOI: 10.7270/Q2Z0387W
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor


(Homo sapiens (Human))
BDBM50298011
PNG
(CHEMBL563301 | methyl 3-(3-(3(3-fluoro-4hydroxyphe...)
Show SMILES COC(=O)CCc1nc(no1)C1CC(=NO1)c1ccc(O)c(F)c1 |c:14|
Show InChI InChI=1S/C15H14FN3O5/c1-22-14(21)5-4-13-17-15(19-24-13)12-7-10(18-23-12)8-2-3-11(20)9(16)6-8/h2-3,6,12,20H,4-5,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5.00E+4n/an/an/an/an/an/a



Piramal Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of dopachrome tautomerase activity of MIF in human THP1 cells


Bioorg Med Chem Lett 19: 4773-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.052
BindingDB Entry DOI: 10.7270/Q2Z0387W
More data for this
Ligand-Target Pair