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BDBM50385910 CHEMBL2041587

SMILES: CC1CCCCC1NC(=O)C(N(CCc1ccccc1Cl)C(=O)CCl)c1ccccc1Cl

InChI Key: InChIKey=FUADBYKFTGCKPV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50385910   
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))
BDBM50385910
PNG
(CHEMBL2041587)
Show SMILES CC1CCCCC1NC(=O)C(N(CCc1ccccc1Cl)C(=O)CCl)c1ccccc1Cl
Show InChI InChI=1S/C25H29Cl3N2O2/c1-17-8-2-7-13-22(17)29-25(32)24(19-10-4-6-12-21(19)28)30(23(31)16-26)15-14-18-9-3-5-11-20(18)27/h3-6,9-12,17,22,24H,2,7-8,13-16H2,1H3,(H,29,32)
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a 880n/an/an/an/an/an/a



Instituto de Qu£mica M£dica (CSIC)

Curated by ChEMBL


Assay Description
Inhibition of PDE7A1


J Med Chem 55: 3274-84 (2012)


Article DOI: 10.1021/jm201720d
BindingDB Entry DOI: 10.7270/Q2ZS2XJB
More data for this
Ligand-Target Pair