null

SMILES: COc1ccc(C(Cc2ccncc2)c2ccc(Cl)cc2)c(F)c1OC1CCCC1

InChI Key: InChIKey=IZHRHJLGDDERDG-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50113413   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50113413 (4-[2-(4-Chloro-phenyl)-2-(3-cyclopentyloxy-2-fluor...) Show SMILES COc1ccc(C(Cc2ccncc2)c2ccc(Cl)cc2)c(F)c1OC1CCCC1 Show InChI InChI=1S/C25H25ClFNO2/c1-29-23-11-10-21(24(27)25(23)30-20-4-2-3-5-20)22(16-17-12-14-28-15-13-17)18-6-8-19(26)9-7-18/h6-15,20,22H,2-5,16H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibitory concentration against human PDE4A isoform using a construct representing the common region of spliced variants expressed as GST-fusion pro...				Bioorg Med Chem Lett 12: 1457-61 (2002) BindingDB Entry DOI: 10.7270/Q2KP82PM
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A (Homo sapiens (Human))	BDBM50113413 (4-[2-(4-Chloro-phenyl)-2-(3-cyclopentyloxy-2-fluor...) Show SMILES COc1ccc(C(Cc2ccncc2)c2ccc(Cl)cc2)c(F)c1OC1CCCC1 Show InChI InChI=1S/C25H25ClFNO2/c1-29-23-11-10-21(24(27)25(23)30-20-4-2-3-5-20)22(16-17-12-14-28-15-13-17)18-6-8-19(26)9-7-18/h6-15,20,22H,2-5,16H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibitory concentration of compound against LPS- induced TNF-alpha production in whole human blood assay				Bioorg Med Chem Lett 12: 1457-61 (2002) BindingDB Entry DOI: 10.7270/Q2KP82PM
					More data for this Ligand-Target Pair