BDBM50215888 CHEMBL336584

SMILES: COc1ccc(cc1OC1CCCC1)C1(Cc2cc[n+]([O-])cc2)CCN(C(=O)OC(C)(C)C)C1=O

InChI Key: InChIKey=PKUYHRMPDZBAFY-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 50215888   

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
Phosphodiesterase 4 (Homo sapiens (Human))	BDBM50215888 (CHEMBL336584) Show SMILES COc1ccc(cc1OC1CCCC1)C1(Cc2cc[n+]([O-])cc2)CCN(C(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C27H34N2O6/c1-26(2,3)35-25(31)29-16-13-27(24(29)30,18-19-11-14-28(32)15-12-19)20-9-10-22(33-4)23(17-20)34-21-7-5-6-8-21/h9-12,14-15,17,21H,5-8,13,16,18H2,1-4H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	217	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Central Research Curated by ChEMBL					Assay Description Affinity for phosphodiesterase (PDE IV) in guinea pig brain membrane using [3H]rolipram displacement.				Bioorg Med Chem Lett 8: 399-404 (1998) BindingDB Entry DOI: 10.7270/Q2222WZ0
					More data for this Ligand-Target Pair
Phosphodiesterase 4 (Homo sapiens (Human))	BDBM50215888 (CHEMBL336584) Show SMILES COc1ccc(cc1OC1CCCC1)C1(Cc2cc[n+]([O-])cc2)CCN(C(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C27H34N2O6/c1-26(2,3)35-25(31)29-16-13-27(24(29)30,18-19-11-14-28(32)15-12-19)20-9-10-22(33-4)23(17-20)34-21-7-5-6-8-21/h9-12,14-15,17,21H,5-8,13,16,18H2,1-4H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Rh£ne-Poulenc Rorer Central Research Curated by ChEMBL					Assay Description In vitro inhibition of phosphodiesterase (PDE IV) from guinea pig macrophages.				Bioorg Med Chem Lett 8: 399-404 (1998) BindingDB Entry DOI: 10.7270/Q2222WZ0
					More data for this Ligand-Target Pair