BDBM50164378 CHEMBL1555332

SMILES: CCCCc1nn2c(nc(CN(CC)c3ccccc3)cc2=O)s1

InChI Key: InChIKey=PTJKTJRYDXVUPM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50164378   

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
GRIA2 (Homo sapiens (Human))	BDBM50164378 (CHEMBL1555332) Show SMILES CCCCc1nn2c(nc(CN(CC)c3ccccc3)cc2=O)s1 Show InChI InChI=1S/C18H22N4OS/c1-3-5-11-16-20-22-17(23)12-14(19-18(22)24-16)13-21(4-2)15-9-7-6-8-10-15/h6-10,12H,3-5,11,13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.37E+4	n/a	n/a	n/a	n/a
Pharmaron-Beijing Co. Ltd. Curated by ChEMBL					Assay Description Positive allosteric modulation of human GluA2 AMPAR flip isomer expressed in Dox-inducible cells measured every 5 mins by BD calcium indicator dye ba...				J Med Chem 59: 2760-79 (2016) BindingDB Entry DOI: 10.7270/Q2N87CQW
					More data for this Ligand-Target Pair
GRIA2 (Homo sapiens (Human))	BDBM50164378 (CHEMBL1555332) Show SMILES CCCCc1nn2c(nc(CN(CC)c3ccccc3)cc2=O)s1 Show InChI InChI=1S/C18H22N4OS/c1-3-5-11-16-20-22-17(23)12-14(19-18(22)24-16)13-21(4-2)15-9-7-6-8-10-15/h6-10,12H,3-5,11,13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.52E+4	n/a	n/a	n/a	n/a
Pharmaron-Beijing Co. Ltd. Curated by ChEMBL					Assay Description Positive allosteric modulation of human GluA2 AMPAR flip isomer expressed in Dox-inducible cells measured every 5 mins by BD calcium indicator dye ba...				J Med Chem 59: 2760-79 (2016) BindingDB Entry DOI: 10.7270/Q2N87CQW
					More data for this Ligand-Target Pair
NR1/NR2A (Homo sapiens (Human))	BDBM50164378 (CHEMBL1555332) Show SMILES CCCCc1nn2c(nc(CN(CC)c3ccccc3)cc2=O)s1 Show InChI InChI=1S/C18H22N4OS/c1-3-5-11-16-20-22-17(23)12-14(19-18(22)24-16)13-21(4-2)15-9-7-6-8-10-15/h6-10,12H,3-5,11,13H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9.34E+3	n/a	n/a	n/a	n/a
Pharmaron-Beijing Co. Ltd. Curated by ChEMBL					Assay Description Positive allosteric modulation of GluN1/GluN2A NMDAR (unknown origin) expressed in Dox-inducible cells measured every 5 mins by BD calcium indicator ...				J Med Chem 59: 2760-79 (2016) BindingDB Entry DOI: 10.7270/Q2N87CQW
					More data for this Ligand-Target Pair