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Compile Data Set for Download or QSAR

Found 3 hits with Last Name = 'hetta' and Initial = 'mh'   
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
Nitric oxide synthase, inducible


(Mus musculus (mouse))
BDBM50194429
PNG
((-)-parthenolide | (1aR,7aS,10aS,10bS,Z)-1a,5-dime...)
Show SMILES C\C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)C(=C)[C@@H]2CC1 |r,t:1|
Show InChI InChI=1S/C15H20O3/c1-9-5-4-8-15(3)13(18-15)12-11(7-6-9)10(2)14(16)17-12/h5,11-13H,2,4,6-8H2,1,3H3/b9-5-/t11-,12-,13-,15+/m0/s1
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KEGG
PC cid
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Article
PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



The University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of iNOS in LPS-induced mouse RAW264.7 cells assessed as inhibition of nitric acid at measured after 24 hrs


J Nat Prod 76: 679-84 (2013)


Article DOI: 10.1021/np300893n
BindingDB Entry DOI: 10.7270/Q2ZW1N83
More data for this
Ligand-Target Pair
Myc proto-oncogene protein


(Homo sapiens (Human))
BDBM23926
PNG
((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)
Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
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Article
PubMed
n/an/a 6.00E+4n/an/an/an/an/an/a



The University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of Myc signaling pathway in human HeLa cells assessed as inhibition of PMA induced luciferase treated 30 mins before induction


J Nat Prod 76: 679-84 (2013)


Article DOI: 10.1021/np300893n
BindingDB Entry DOI: 10.7270/Q2ZW1N83
More data for this
Ligand-Target Pair
Myc proto-oncogene protein


(Homo sapiens (Human))
BDBM50431277
PNG
((Z)-3,4,3'',5''-Tetramethoxystilbene | (Z)-3,4,3',...)
Show SMILES COc1cc(OC)cc(\C=C/c2ccc(OC)c(OC)c2)c1
Show InChI InChI=1S/C18H20O4/c1-19-15-9-14(10-16(12-15)20-2)6-5-13-7-8-17(21-3)18(11-13)22-4/h5-12H,1-4H3/b6-5-
PDB
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PC cid
PC sid
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Article
PubMed
n/an/a 6.00E+4n/an/an/an/an/an/a



The University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of Myc signaling pathway in human HeLa cells assessed as inhibition of PMA induced luciferase treated 30 mins before induction


J Nat Prod 76: 679-84 (2013)


Article DOI: 10.1021/np300893n
BindingDB Entry DOI: 10.7270/Q2ZW1N83
More data for this
Ligand-Target Pair