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BDBM50170473 6-Phenoxymethyl-pyridine-2-carboxylic acid (4-hydroxycarbamoylmethyl-5-methyl-thiazol-2-yl)-amide::CHEMBL190849

SMILES: Cc1sc(NC(=O)c2cccc(COc3ccccc3)n2)nc1CC(=O)NO

InChI Key: InChIKey=IFMVPLWFKLYRDU-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 = 50170473   
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))
BDBM50170473
PNG
(6-Phenoxymethyl-pyridine-2-carboxylic acid (4-hydr...)
Show SMILES Cc1sc(NC(=O)c2cccc(COc3ccccc3)n2)nc1CC(=O)NO
Show InChI InChI=1S/C19H18N4O4S/c1-12-16(10-17(24)23-26)21-19(28-12)22-18(25)15-9-5-6-13(20-15)11-27-14-7-3-2-4-8-14/h2-9,26H,10-11H2,1H3,(H,23,24)(H,21,22,25)
PDB
MMDB

Reactome pathway
KEGG

B.MOAD
DrugBank
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 40n/an/an/an/an/an/a



Sumitomo Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibitory concentration against Phosphodiesterase type 5


Bioorg Med Chem Lett 15: 4085-90 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.016
BindingDB Entry DOI: 10.7270/Q22B8XKH
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Homo sapiens (Human))
BDBM50170473
PNG
(6-Phenoxymethyl-pyridine-2-carboxylic acid (4-hydr...)
Show SMILES Cc1sc(NC(=O)c2cccc(COc3ccccc3)n2)nc1CC(=O)NO
Show InChI InChI=1S/C19H18N4O4S/c1-12-16(10-17(24)23-26)21-19(28-12)22-18(25)15-9-5-6-13(20-15)11-27-14-7-3-2-4-8-14/h2-9,26H,10-11H2,1H3,(H,23,24)(H,21,22,25)
PDB
MMDB

KEGG

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

Similars

Article
PubMed
n/an/a 4.52E+3n/an/an/an/an/an/a



Sumitomo Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibitory concentration against Phosphodiesterase type 1


Bioorg Med Chem Lett 15: 4085-90 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.016
BindingDB Entry DOI: 10.7270/Q22B8XKH
More data for this
Ligand-Target Pair