BindingDB logo
myBDB logout

BDBM50297815 2-amino-4-(cyclohexylmethyl)-6-(4-fluorophenyl)pyrido[2,3-b]pyrazin-3(4H)-one::CHEMBL557755

SMILES: Nc1nc2ccc(nc2n(CC2CCCCC2)c1=O)-c1ccc(F)cc1

InChI Key: InChIKey=BFNPJAQSOHVLRB-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 = 50297815   
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))
BDBM50297815
PNG
(2-amino-4-(cyclohexylmethyl)-6-(4-fluorophenyl)pyr...)
Show SMILES Nc1nc2ccc(nc2n(CC2CCCCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C20H21FN4O/c21-15-8-6-14(7-9-15)16-10-11-17-19(24-16)25(20(26)18(22)23-17)12-13-4-2-1-3-5-13/h6-11,13H,1-5,12H2,(H2,22,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 28n/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))
BDBM50297815
PNG
(2-amino-4-(cyclohexylmethyl)-6-(4-fluorophenyl)pyr...)
Show SMILES Nc1nc2ccc(nc2n(CC2CCCCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C20H21FN4O/c21-15-8-6-14(7-9-15)16-10-11-17-19(24-16)25(20(26)18(22)23-17)12-13-4-2-1-3-5-13/h6-11,13H,1-5,12H2,(H2,22,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 29n/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