BDBM50363910 CHEMBL1946934

SMILES: COc1ccc(C2=NNC(=O)CC2C)c2cc(sc12)C(F)(F)F

InChI Key: InChIKey=SZBZFVTWALNUPE-UHFFFAOYSA-N

Data: 2 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 = 50363910   

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
3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50363910 (CHEMBL1946934) Show SMILES COc1ccc(C2=NNC(=O)CC2C)c2cc(sc12)C(F)(F)F |t:6| Show InChI InChI=1S/C15H13F3N2O2S/c1-7-5-12(21)19-20-13(7)8-3-4-10(22-2)14-9(8)6-11(23-14)15(16,17)18/h3-4,6-7H,5H2,1-2H3,(H,19,21)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Kyorin Pharmaceutical Co. Ltd. Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain				Bioorg Med Chem 20: 1644-58 (2012) Article DOI: 10.1016/j.bmc.2012.01.033 BindingDB Entry DOI: 10.7270/Q2DB829P
					More data for this Ligand-Target Pair
Phosphodiesterase 3 (PDE3) (Homo sapiens (Human))	BDBM50363910 (CHEMBL1946934) Show SMILES COc1ccc(C2=NNC(=O)CC2C)c2cc(sc12)C(F)(F)F |t:6| Show InChI InChI=1S/C15H13F3N2O2S/c1-7-5-12(21)19-20-13(7)8-3-4-10(22-2)14-9(8)6-11(23-14)15(16,17)18/h3-4,6-7H,5H2,1-2H3,(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyorin Pharmaceutical Co. Ltd. Curated by ChEMBL					Assay Description Inhibition of human PDE3A catalytic domain				Bioorg Med Chem 20: 1644-58 (2012) Article DOI: 10.1016/j.bmc.2012.01.033 BindingDB Entry DOI: 10.7270/Q2DB829P
					More data for this Ligand-Target Pair