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BDBM50026875 CHEMBL537252

SMILES: Cl.COc1cc2cc(CO)c(CO)c(-c3cccc(n3)-n3nc(-c4cccnc4)c4ccccc4c3=O)c2cc1OC

InChI Key: InChIKey=ROFXZKAVEHAJJA-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50026875   
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
Phosphodiesterase 4


(Homo sapiens (Human))
BDBM50026875
PNG
(CHEMBL537252)
Show SMILES Cl.COc1cc2cc(CO)c(CO)c(-c3cccc(n3)-n3nc(-c4cccnc4)c4ccccc4c3=O)c2cc1OC
Show InChI InChI=1S/C32H26N4O5.ClH/c1-40-27-14-20-13-21(17-37)25(18-38)30(24(20)15-28(27)41-2)26-10-5-11-29(34-26)36-32(39)23-9-4-3-8-22(23)31(35-36)19-7-6-12-33-16-19;/h3-16,37-38H,17-18H2,1-2H3;1H
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Tanabe Seiyaku Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of Phosphodiesterase 4 from guinea pig lung


J Med Chem 42: 1088-99 (1999)


Article DOI: 10.1021/jm980314l
BindingDB Entry DOI: 10.7270/Q25M66DH
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50026875
PNG
(CHEMBL537252)
Show SMILES Cl.COc1cc2cc(CO)c(CO)c(-c3cccc(n3)-n3nc(-c4cccnc4)c4ccccc4c3=O)c2cc1OC
Show InChI InChI=1S/C32H26N4O5.ClH/c1-40-27-14-20-13-21(17-37)25(18-38)30(24(20)15-28(27)41-2)26-10-5-11-29(34-26)36-32(39)23-9-4-3-8-22(23)31(35-36)19-7-6-12-33-16-19;/h3-16,37-38H,17-18H2,1-2H3;1H
PDB
MMDB

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.60E+3n/an/an/an/an/an/a



Tanabe Seiyaku Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of Phosphodiesterase 3 activity from guinea pig cardiac ventricle


J Med Chem 42: 1088-99 (1999)


Article DOI: 10.1021/jm980314l
BindingDB Entry DOI: 10.7270/Q25M66DH
More data for this
Ligand-Target Pair