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BDBM50381289 CHEMBL2019102

SMILES: COc1cc(NCCN)ccc1-c1nc2snc(C3CCCCC3)c2c(=O)[nH]1

InChI Key: InChIKey=XDMIBIMJQCBSDR-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50381289   
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 7


(Homo sapiens (Human))
BDBM50381289
PNG
(CHEMBL2019102)
Show SMILES COc1cc(NCCN)ccc1-c1nc2snc(C3CCCCC3)c2c(=O)[nH]1
Show InChI InChI=1S/C20H25N5O2S/c1-27-15-11-13(22-10-9-21)7-8-14(15)18-23-19(26)16-17(25-28-20(16)24-18)12-5-3-2-4-6-12/h7-8,11-12,22H,2-6,9-10,21H2,1H3,(H,23,24,26)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 46n/an/an/an/an/an/a



Glenmark Pharmaceuticals Limited

Curated by ChEMBL


Assay Description
Displacement of [3H]-cAMP from human recombinant PDE7A


Bioorg Med Chem Lett 22: 3223-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.025
BindingDB Entry DOI: 10.7270/Q2NP25F2
More data for this
Ligand-Target Pair