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BDBM200694 US9233086, 7B

SMILES: CCC(CC)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(C)=O

InChI Key: InChIKey=RMDBISVNAIDQMJ-HUBLWGQQSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 200694   
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
WD repeat-containing protein 5 (WDR5)


(Homo sapiens (Human))
BDBM200694
PNG
(US9233086, 7B)
Show SMILES CCC(CC)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(C)=O |r|
Show InChI InChI=1S/C19H37N7O4/c1-6-14(7-2)25-16(28)12(4)24-18(30)15(9-8-10-22-19(20)21)26-17(29)11(3)23-13(5)27/h11-12,14-15H,6-10H2,1-5H3,(H,23,27)(H,24,30)(H,25,28)(H,26,29)(H4,20,21,22)/t11-,12-,15-/m0/s1
PDB
MMDB

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KEGG
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/a6.525



THE REGENTS OF THE UNIVERSITY OF MICHIGAN

US Patent


Assay Description
N-terminal His-tagged WDR5Δ23 (residues 24-334) was expressed from the pET28-MHL vector in Rosetta2(DE3) pLysS cells (Novagen). Cells were grown...


US Patent US9233086 (2016)


BindingDB Entry DOI: 10.7270/Q27943GX
More data for this
Ligand-Target Pair