BDBM50365060 CHEMBL1951069

SMILES: COc1ccc(cc1OC)C1=NN(CCCCCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12

InChI Key: InChIKey=MZTWQKXZMWWZFH-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50365060   

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
Beta-2 adrenergic receptor (GUINEA PIG)	BDBM50365060 (CHEMBL1951069) Show SMILES COc1ccc(cc1OC)C1=NN(CCCCCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |t:11| Show InChI InChI=1S/C30H40N4O6/c1-39-27-13-11-21(17-28(27)40-2)29-22-8-4-5-9-23(22)30(38)34(33-29)15-7-3-6-14-31-18-26(37)20-10-12-25(36)24(16-20)32-19-35/h10-13,16-17,19,22-23,26,31,36-37H,3-9,14-15,18H2,1-2H3,(H,32,35)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	19.9	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Agonist activity at beta2 adrenoceptor in guinea pig assessed as relaxation of histamine-induced tracheal ring contraction				Bioorg Med Chem Lett 22: 1523-6 (2012) Article DOI: 10.1016/j.bmcl.2012.01.013 BindingDB Entry DOI: 10.7270/Q2794548
					More data for this Ligand-Target Pair
3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50365060 (CHEMBL1951069) Show SMILES COc1ccc(cc1OC)C1=NN(CCCCCNCC(O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |t:11| Show InChI InChI=1S/C30H40N4O6/c1-39-27-13-11-21(17-28(27)40-2)29-22-8-4-5-9-23(22)30(38)34(33-29)15-7-3-6-14-31-18-26(37)20-10-12-25(36)24(16-20)32-19-35/h10-13,16-17,19,22-23,26,31,36-37H,3-9,14-15,18H2,1-2H3,(H,32,35)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	257	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of human recombinant PDE4B2-mediated cAMP hydrolysis for 30 mins by colorimetric assay				Bioorg Med Chem Lett 22: 1523-6 (2012) Article DOI: 10.1016/j.bmcl.2012.01.013 BindingDB Entry DOI: 10.7270/Q2794548
					More data for this Ligand-Target Pair