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SMILES: COc1ccc(cc1Cl)C(C)Nc1c2CN(CCc2nc2ccc(cc12)C#N)C(C)=O

InChI Key: InChIKey=ZJEMKZMTQHUENK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 480503   
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
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM480503
PNG
(US10899756, Compound V)
Show SMILES COc1ccc(cc1Cl)C(C)Nc1c2CN(CCc2nc2ccc(cc12)C#N)C(C)=O
Show InChI InChI=1S/C24H23ClN4O2/c1-14(17-5-7-23(31-3)20(25)11-17)27-24-18-10-16(12-26)4-6-21(18)28-22-8-9-29(15(2)30)13-19(22)24/h4-7,10-11,14H,8-9,13H2,1-3H3,(H,27,28)
PDB
MMDB

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US Patent
n/an/a 26.9n/an/an/an/an/an/a



The Trustees of Columbia University in the City of New York

US Patent


Assay Description
A series of dilutions of the test compounds were prepared with 10% DMSO in assay buffer and 5 μl of the dilution was added to a 50 μl react...


US Patent US10899756 (2021)

More data for this
Ligand-Target Pair