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BDBM50297813 6-(4-fluorophenyl)-4-(2-propoxyethyl)-2-((tetrahydro-2H-pyran-4-yl)methylamino)pyrido[2,3-b]pyrazin-3(4H)-one::CHEMBL558466

SMILES: CCCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(F)cc1

InChI Key: InChIKey=UAMMPZAQBXSNGC-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50297813   
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
3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50297813
PNG
(6-(4-fluorophenyl)-4-(2-propoxyethyl)-2-((tetrahyd...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C24H29FN4O3/c1-2-12-31-15-11-29-23-21(8-7-20(28-23)18-3-5-19(25)6-4-18)27-22(24(29)30)26-16-17-9-13-32-14-10-17/h3-8,17H,2,9-16H2,1H3,(H,26,27)
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PC cid
PC sid
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Similars

Article
n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PDE5 (unknown origin)


Citation and Details

Article DOI: 10.1007/s00044-010-9523-y
BindingDB Entry DOI: 10.7270/Q2JW8HS3
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50297813
PNG
(6-(4-fluorophenyl)-4-(2-propoxyethyl)-2-((tetrahyd...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C24H29FN4O3/c1-2-12-31-15-11-29-23-21(8-7-20(28-23)18-3-5-19(25)6-4-18)27-22(24(29)30)26-16-17-9-13-32-14-10-17/h3-8,17H,2,9-16H2,1H3,(H,26,27)
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
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antibodypedia
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AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 22n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair