BDBM50232366 CHEMBL4065636

SMILES: Cc1nn(c2NC(=O)CC(c12)c1ccc(COc2cccc(Cl)c2)cc1)-c1nc(C)cc(C)n1

InChI Key: InChIKey=BFJWHNFHTLBCGG-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50232366   

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
G-protein coupled receptor 39 (Homo sapiens (Human))	BDBM50232366 (CHEMBL4065636) Show SMILES Cc1nn(c2NC(=O)CC(c12)c1ccc(COc2cccc(Cl)c2)cc1)-c1nc(C)cc(C)n1 Show InChI InChI=1S/C26H24ClN5O2/c1-15-11-16(2)29-26(28-15)32-25-24(17(3)31-32)22(13-23(33)30-25)19-9-7-18(8-10-19)14-34-21-6-4-5-20(27)12-21/h4-12,22H,13-14H2,1-3H3,(H,30,33)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Agonist activity at human GPR39 expressed in HEK293 cells co-expressing Galphaq assessed as myo-[2-3H]inositol phosphate accumulation measured after ...				J Med Chem 60: 886-898 (2017) BindingDB Entry DOI: 10.7270/Q2VT1VBV
					More data for this Ligand-Target Pair