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BDBM378302 (2R,4S)-N-(1-(1-(L-alanyl)piperidin-4-yl)ethyl)-4-hydroxypyrrolidine-2-carboxamide::US10266526, Compound 433

SMILES: C[C@H](N)C(=O)N1CCC(CC1)C(C)NC(=O)[C@H]1C[C@H](O)CN1

InChI Key: InChIKey=FFMVOBMOMXPHEU-FZMOHWGLSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 378302   
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
Histone-lysine N-methyltransferase SMYD3


(Homo sapiens (Human))
BDBM378302
PNG
((2R,4S)-N-(1-(1-(L-alanyl)piperidin-4-yl)ethyl)-4-...)
Show SMILES C[C@H](N)C(=O)N1CCC(CC1)C(C)NC(=O)[C@H]1C[C@H](O)CN1
Show InChI InChI=1S/C15H28N4O3/c1-9(16)15(22)19-5-3-11(4-6-19)10(2)18-14(21)13-7-12(20)8-17-13/h9-13,17,20H,3-8,16H2,1-2H3,(H,18,21)/t9-,10?,12-,13+/m0/s1
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 4.57E+4n/an/an/an/an/an/a



Epizyme Inc

US Patent


Assay Description
The assays were all performed in a buffer consisting of 25 mM Tris-Cl pH 8.0, 1 mM TCEP, 0.005% BSG, and 0.005% Tween 20, prepared on the day of use....


US Patent US10266526 (2019)


BindingDB Entry DOI: 10.7270/Q2DJ5HX2
More data for this
Ligand-Target Pair