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BDBM258413 US9505786, 55

SMILES: CC1(C)C(=O)Nc2nc(nc(CNS(=O)(=O)C3CC3)c12)-c1nn(Cc2ccccc2F)c2ncc(F)cc12

InChI Key: InChIKey=GWKDSIYNUNGZOW-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 258413   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM258413
PNG
(US9505786, 55)
Show SMILES CC1(C)C(=O)Nc2nc(nc(CNS(=O)(=O)C3CC3)c12)-c1nn(Cc2ccccc2F)c2ncc(F)cc12
Show InChI InChI=1S/C25H23F2N7O3S/c1-25(2)19-18(11-29-38(36,37)15-7-8-15)30-22(31-21(19)32-24(25)35)20-16-9-14(26)10-28-23(16)34(33-20)12-13-5-3-4-6-17(13)27/h3-6,9-10,15,29H,7-8,11-12H2,1-2H3,(H,30,31,32,35)
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 190n/an/an/an/a7.525



Bayer Pharma Aktiengesellschaft

US Patent


Assay Description
To determine their in vitro action on human PDE 5, the test substances are dissolved in 100% DMSO and serially diluted. Typically, dilution series (1...


US Patent US9505786 (2016)


BindingDB Entry DOI: 10.7270/Q2WS8S6V
More data for this
Ligand-Target Pair