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SMILES: COc1ccc(cc1OC)C1=NN(C\C=C\c2ccccc2)C(=O)C2CCCCC12

InChI Key: InChIKey=KKMHBNSEVLDXRU-DHZHZOJOSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50473724   
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
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))		BDBM50473724
PNG
(CHEMBL313272)
Show SMILES COc1ccc(cc1OC)C1=NN(C\C=C\c2ccccc2)C(=O)C2CCCCC12 |t:11|
Show InChI InChI=1S/C25H28N2O3/c1-29-22-15-14-19(17-23(22)30-2)24-20-12-6-7-13-21(20)25(28)27(26-24)16-8-11-18-9-4-3-5-10-18/h3-5,8-11,14-15,17,20-21H,6-7,12-13,16H2,1-2H3/b11-8+
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 4 (PDE4) in cytosol of human neutrophils

J Med Chem 45: 2520-5 (2002)


Article DOI: 10.1021/jm0110340
BindingDB Entry DOI: 10.7270/Q2862K56
More data for this
Ligand-Target Pair