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BDBM50052087 CHEMBL91778::[1-(3,4-Dimethoxy-phenyl)-3-hydroxymethyl-6,7-dimethoxy-naphthalen-2-yl]-methanol

SMILES: COc1ccc(cc1OC)-c1c(CO)c(CO)cc2cc(OC)c(OC)cc12

InChI Key: InChIKey=XLIGEVMSLRBZGG-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50052087   
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))
BDBM50052087
PNG
(CHEMBL91778 | [1-(3,4-Dimethoxy-phenyl)-3-hydroxym...)
Show SMILES COc1ccc(cc1OC)-c1c(CO)c(CO)cc2cc(OC)c(OC)cc12
Show InChI InChI=1S/C22H24O6/c1-25-18-6-5-13(8-19(18)26-2)22-16-10-21(28-4)20(27-3)9-14(16)7-15(11-23)17(22)12-24/h5-10,23-24H,11-12H2,1-4H3
PDB
MMDB

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Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Tan£be Seiyaku Company, Ltd.

Curated by ChEMBL


Assay Description
Inhibition in vitro of Phosphodiesterase 5 isolated from guinea pig lung


J Med Chem 39: 2696-704 (1996)


Article DOI: 10.1021/jm9509096
BindingDB Entry DOI: 10.7270/Q2WS8TW7
More data for this
Ligand-Target Pair