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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '1,5-anhydro-D-fructose reductase' and Ligand = 'BDBM269339'   
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
1,5-anhydro-D-fructose reductase


(Homo sapiens (Human))
BDBM269339
PNG
((R)-4,4-dimethyl-2-(3-methyl-4'-(1-methyl-1H-pyraz...)
Show SMILES Cc1cc(ccc1C1=NC(C)(C)C(=O)N1C[C@@H]1CCN(C1)C(=O)C1(C)CC1)-c1ccc(cc1)-c1cnn(C)c1
Show InChI InChI=1S/C32H37N5O2/c1-21-16-25(23-6-8-24(9-7-23)26-17-33-35(5)20-26)10-11-27(21)28-34-31(2,3)29(38)37(28)19-22-12-15-36(18-22)30(39)32(4)13-14-32/h6-11,16-17,20,22H,12-15,18-19H2,1-5H3/t22-/m1/s1
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 53.7n/an/an/an/a7.525



Janssen Pharmaceutica NV

US Patent


Assay Description
10 μL assay buffer (100 mM KH2PO4 pH 7.5) was added to a 384-well clear plate (costar 3702). 0.3 μL compound (at concentrations of 30 μ...


US Patent US9718813 (2017)

More data for this
Ligand-Target Pair