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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 225240   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein G9a (G9a)


(Homo sapiens (Human))
BDBM225240
PNG
(3,5-Difluoro-N-(2-phenylbenzo[d]oxazol-6-yl)benzen...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(O)=O
Show InChI InChI=1S/C46H64N11O18P/c1-23(2)38(44(68)53-29(15-16-37(61)62)40(64)51-24(3)39(63)55-32(46(70)71)21-35(49)59)56-42(66)31(19-26-11-13-27(14-12-26)75-76(72,73)74)54-41(65)30(18-25-8-5-4-6-9-25)52-36(60)22-50-43(67)33-10-7-17-57(33)45(69)28(47)20-34(48)58/h4-6,8-9,11-14,23-24,28-33,38H,7,10,15-22,47H2,1-3H3,(H2,48,58)(H2,49,59)(H,50,67)(H,51,64)(H,52,60)(H,53,68)(H,54,65)(H,55,63)(H,56,66)(H,61,62)(H,70,71)(H2,72,73,74)/t24-,28-,29-,30-,31-,32-,33-,38-/m0/s1
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GoogleScholar
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.32E+4n/an/an/an/a8.525



Shenyang Pharmaceutical University



Assay Description
Biochemical activity of G9a was measured as described [Kubicek et al., Mol. Cell, 25:473-481]. Assays were performed in white, opaque 384-well plates...


Bioorg Chem 72: 168-181 (2017)


Article DOI: 10.1016/j.bioorg.2017.04.005
BindingDB Entry DOI: 10.7270/Q2T152HV
More data for this
Ligand-Target Pair