BindingDB logo
myBDB logout

BDBM93140 PDE5 Inhibitor, 12

SMILES: COc1ccc([C@@H]2c3[nH]c4ccccc4c3Cc3c(O)n(c(=O)n23)C(C)(C)C)c(OC)c1

InChI Key: InChIKey=QWKOMLLJXATSJE-JOCHJYFZSA-N

Data: 1 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 1 hit for monomerid = 93140   
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))
BDBM93140
PNG
(PDE5 Inhibitor, 12)
Show SMILES COc1ccc([C@@H]2c3[nH]c4ccccc4c3Cc3c(O)n(c(=O)n23)C(C)(C)C)c(OC)c1
Show InChI InChI=1S/C25H27N3O4/c1-25(2,3)28-23(29)19-13-17-15-8-6-7-9-18(15)26-21(17)22(27(19)24(28)30)16-11-10-14(31-4)12-20(16)32-5/h6-12,22,26,29H,13H2,1-5H3/t22-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

n/an/a 550n/an/an/an/an/an/a



German University in Cairo



Assay Description
PDE activity was measured using a modification of the IMAP fluorescence polarization phosphodiesterase assay from Molecular Devices. The assay was m...


International Journal of Medicinal Chemistry 2011: 1-9 (2011)


BindingDB Entry DOI: 10.7270/Q21R6P59
More data for this
Ligand-Target Pair