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PubMed code 12036350

Compile data set for download or QSAR
Found 9 hits of 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/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113768
PNG
((S)-methyl 2-(4-hydroxybenzylideneamino)-3-(1H-ind...)
Show SMILES COC(=O)[C@H](Cc1c[nH]c2ccccc12)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C19H18N2O3/c1-24-19(23)18(20-11-13-6-8-15(22)9-7-13)10-14-12-21-17-5-3-2-4-16(14)17/h2-9,11-12,18,21-22H,10H2,1H3/b20-11+/t18-/m0/s1
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Article
PubMed
n/an/a 1.65E+3n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113775
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-3-(4-hydroxy-phe...)
Show SMILES COC(=O)[C@@H](Cc1ccc(O)cc1)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C17H17NO4/c1-22-17(21)16(10-12-2-6-14(19)7-3-12)18-11-13-4-8-15(20)9-5-13/h2-9,11,16,19-20H,10H2,1H3/b18-11+/t16-/m1/s1
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Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113772
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-3-phenyl-propion...)
Show SMILES COC(=O)[C@@H](Cc1ccccc1)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C17H17NO3/c1-21-17(20)16(11-13-5-3-2-4-6-13)18-12-14-7-9-15(19)10-8-14/h2-10,12,16,19H,11H2,1H3/b18-12+/t16-/m1/s1
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Article
PubMed
n/an/a 5.00E+4n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113773
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-3-(1H-indol-3-yl...)
Show SMILES COC(=O)[C@@H](Cc1c[nH]c2ccccc12)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C19H18N2O3/c1-24-19(23)18(20-11-13-6-8-15(22)9-7-13)10-14-12-21-17-5-3-2-4-16(14)17/h2-9,11-12,18,21-22H,10H2,1H3/b20-11+/t18-/m1/s1
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113774
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-butyric acid met...)
Show SMILES CC[C@H](\N=C\c1ccc(O)cc1)C(=O)OC
Show InChI InChI=1S/C12H15NO3/c1-3-11(12(15)16-2)13-8-9-4-6-10(14)7-5-9/h4-8,11,14H,3H2,1-2H3/b13-8+/t11-/m0/s1
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Article
PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113769
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-propionic acid m...)
Show SMILES COC(=O)[C@H](C)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C11H13NO3/c1-8(11(14)15-2)12-7-9-3-5-10(13)6-4-9/h3-8,13H,1-2H3/b12-7+/t8-/m0/s1
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113770
PNG
(4-Hydroxy-2-[(4-hydroxy-benzylidene)-amino]-butyri...)
Show SMILES COC(=O)[C@H](CCO)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C12H15NO4/c1-17-12(16)11(6-7-14)13-8-9-2-4-10(15)5-3-9/h2-5,8,11,14-15H,6-7H2,1H3/b13-8+/t11-/m0/s1
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UniChem

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



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113771
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-4-methyl-pentano...)
Show SMILES COC(=O)[C@H](CC(C)C)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C14H19NO3/c1-10(2)8-13(14(17)18-3)15-9-11-4-6-12(16)7-5-11/h4-7,9-10,13,16H,8H2,1-3H3/b15-9+/t13-/m0/s1
PDB
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KEGG

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PC sid
UniChem

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



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
Macrophage migration inhibitory factor (MIF)


(Homo sapiens (Human))
BDBM50113767
PNG
(2-[(4-Hydroxy-benzylidene)-amino]-5-methylsulfanyl...)
Show SMILES COC(=O)[C@H](CCCSC)\N=C\c1ccc(O)cc1
Show InChI InChI=1S/C14H19NO3S/c1-18-14(17)13(4-3-9-19-2)15-10-11-5-7-12(16)8-6-11/h5-8,10,13,16H,3-4,9H2,1-2H3/b15-10+/t13-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Inhibition of human macrophage migration inhibitory factor tautomerase (MIF) activity


J Med Chem 45: 2410-6 (2002)


Article DOI: 10.1021/jm010534q
BindingDB Entry DOI: 10.7270/Q2WS8SKS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%