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BDBM50089821 4-(3-Chloro-4-methoxy-benzylamino)-1-(4-hydroxy-4-methyl-piperidin-1-yl)-phthalazine-6-carbonitrile; hydrochloride::CHEMBL542418

SMILES: COc1ccc(CNc2nnc(N3CCC(C)(O)CC3)c3ccc(cc23)C#N)cc1Cl

InChI Key: InChIKey=NXDRUTUJYWVZIP-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50089821   
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))
BDBM50089821
PNG
(4-(3-Chloro-4-methoxy-benzylamino)-1-(4-hydroxy-4-...)
Show SMILES COc1ccc(CNc2nnc(N3CCC(C)(O)CC3)c3ccc(cc23)C#N)cc1Cl
Show InChI InChI=1S/C23H24ClN5O2/c1-23(30)7-9-29(10-8-23)22-17-5-3-15(13-25)11-18(17)21(27-28-22)26-14-16-4-6-20(31-2)19(24)12-16/h3-6,11-12,30H,7-10,14H2,1-2H3,(H,26,27)
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Similars

Article
PubMed
n/an/a 0.700n/an/an/an/an/an/a



Eisai Company, Ltd

Curated by ChEMBL


Assay Description
50% inhibitory concentration against phosphodiesterase 5 (PDE5) from porcine platelets


J Med Chem 43: 2523-9 (2000)


Article DOI: 10.1021/jm9905054
BindingDB Entry DOI: 10.7270/Q2T72J4N
More data for this
Ligand-Target Pair