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BDBM50357245 CHEMBL1916481

SMILES: CCCOCCn1c2cc(nnc2c(N[C@H](C)C(O)=O)nc1=O)-c1ccc(OC)nc1

InChI Key: InChIKey=HOKCYKHLUVOXNW-GFCCVEGCSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50357245   
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))
BDBM50357245
PNG
(CHEMBL1916481)
Show SMILES CCCOCCn1c2cc(nnc2c(N[C@H](C)C(O)=O)nc1=O)-c1ccc(OC)nc1 |r|
Show InChI InChI=1S/C20H24N6O5/c1-4-8-31-9-7-26-15-10-14(13-5-6-16(30-3)21-11-13)24-25-17(15)18(23-20(26)29)22-12(2)19(27)28/h5-6,10-12H,4,7-9H2,1-3H3,(H,27,28)(H,22,23,29)/t12-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.130n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 21: 6348-52 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.106
BindingDB Entry DOI: 10.7270/Q2J67HB0
More data for this
Ligand-Target Pair