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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mitotic kinesin Eg5 (Eg5)'   
Target
(Institution)
LigandTarget
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
Mitotic kinesin Eg5 (Eg5)


(Homo sapiens (Human))
BDBM189359
PNG
(SRI35566)
Show SMILES O=C1CC(c2ccccc2)c2c(N1)n1ncnc1[nH]c2=O
Show InChI InChI=1/C14H11N5O2/c20-10-6-9(8-4-2-1-3-5-8)11-12(17-10)19-14(15-7-16-19)18-13(11)21/h1-5,7,9H,6H2,(H,17,20)(H,15,16,18,21)
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Article
PubMed
n/an/a 6.50E+4n/an/an/an/an/an/a



Southern Research Institute



Assay Description
Compounds were first tested in triplicates at 100 uM; hit compounds were further tested with a 10-point twofold serial dilution to confirm their acti...


Chem Biol Drug Des 88: 178-87 (2016)

More data for this
Ligand-Target Pair
Mitotic kinesin Eg5 (Eg5)


(Homo sapiens (Human))
BDBM189360
PNG
(SRI35565)
Show SMILES FC(F)(F)c1ccc(Nc2ncnc3[nH]ncc23)cc1
Show InChI InChI=1S/C12H8F3N5/c13-12(14,15)7-1-3-8(4-2-7)19-10-9-5-18-20-11(9)17-6-16-10/h1-6H,(H2,16,17,18,19,20)
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Similars

AffyNet 
Article
PubMed
n/an/a 7.89E+4n/an/an/an/an/an/a



Southern Research Institute



Assay Description
Compounds were first tested in triplicates at 100 uM; hit compounds were further tested with a 10-point twofold serial dilution to confirm their acti...


Chem Biol Drug Des 88: 178-87 (2016)

More data for this
Ligand-Target Pair
Mitotic kinesin Eg5 (Eg5)


(Homo sapiens (Human))
BDBM189361
PNG
(SRI35564)
Show SMILES Cc1ccc(cc1)C1C(C#N)=C(N)Nc2ncnn12
Show InChI InChI=1/C13H12N6/c1-8-2-4-9(5-3-8)11-10(6-14)12(15)18-13-16-7-17-19(11)13/h2-5,7,11H,15H2,1H3,(H,16,17,18)
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PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 1.18E+5n/an/an/an/an/an/a



Southern Research Institute



Assay Description
Compounds were first tested in triplicates at 100 uM; hit compounds were further tested with a 10-point twofold serial dilution to confirm their acti...


Chem Biol Drug Des 88: 178-87 (2016)

More data for this
Ligand-Target Pair