BDBM50030772 CHEMBL3342360

SMILES: CC(C)(C)CNc1nc(NCC2CC2)cc(n1)-c1ccccn1

InChI Key: InChIKey=SRPSFDVABNXXLS-UHFFFAOYSA-N

Data: 2 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 = 50030772   

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))	BDBM50030772 (CHEMBL3342360) Show SMILES CC(C)(C)CNc1nc(NCC2CC2)cc(n1)-c1ccccn1 Show InChI InChI=1S/C18H25N5/c1-18(2,3)12-21-17-22-15(14-6-4-5-9-19-14)10-16(23-17)20-11-13-7-8-13/h4-6,9-10,13H,7-8,11-12H2,1-3H3,(H2,20,21,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Agonist activity at human GPR39 expressed in HEK293 cells by IP1 assay				ACS Med Chem Lett 5: 1114-8 (2014) Article DOI: 10.1021/ml500240d BindingDB Entry DOI: 10.7270/Q2MC91MW
					More data for this Ligand-Target Pair
G-protein coupled receptor 39 (Mus musculus)	BDBM50030772 (CHEMBL3342360) Show SMILES CC(C)(C)CNc1nc(NCC2CC2)cc(n1)-c1ccccn1 Show InChI InChI=1S/C18H25N5/c1-18(2,3)12-21-17-22-15(14-6-4-5-9-19-14)10-16(23-17)20-11-13-7-8-13/h4-6,9-10,13H,7-8,11-12H2,1-3H3,(H2,20,21,22,23)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Agonist activity at mouse GPR39 expressed in HEK293 cells by IP1 assay				ACS Med Chem Lett 5: 1114-8 (2014) Article DOI: 10.1021/ml500240d BindingDB Entry DOI: 10.7270/Q2MC91MW
					More data for this Ligand-Target Pair