BDBM50150235 CHEMBL3770286

SMILES: [H][C@@]12CCC[C@]1([H])N1C3N(CCc4ccc(cc4)C(C)=O)NC(Nc4ccccc4)=C3C(=O)N(C)C1=N2

InChI Key: InChIKey=ICHUOQWMUTVJLY-RTIVMORXSA-N

Data: 1 KI

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 1 hit for monomerid = 50150235   

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))	BDBM50150235 (CHEMBL3770286) Show SMILES [H][C@@]12CCC[C@]1([H])N1C3N(CCc4ccc(cc4)C(C)=O)NC(Nc4ccccc4)=C3C(=O)N(C)C1=N2 |r,c:32,40| Show InChI InChI=1S/C27H30N6O2/c1-17(34)19-13-11-18(12-14-19)15-16-32-25-23(24(30-32)28-20-7-4-3-5-8-20)26(35)31(2)27-29-21-9-6-10-22(21)33(25)27/h3-5,7-8,11-14,21-22,25,28,30H,6,9-10,15-16H2,1-2H3/t21-,22+,25?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Intra-Cellular Therapies, Inc. Curated by ChEMBL					Assay Description Inhibition of recombinant full lenght human PDE4A using fluorescent labeled cAMP as substrate after 15 mins by IMAP assay				J Med Chem 59: 1149-64 (2016) BindingDB Entry DOI: 10.7270/Q2X068W7
					More data for this Ligand-Target Pair