BDBM50401542 CHEMBL2207075

SMILES: CCN(CC)c1ccc2c(C)c(-c3ccc(cc3)C3C(C#N)C(=N)OC4=C3C(=O)CC(C4)c3ccccc3)c(=O)oc2c1

InChI Key: InChIKey=QLSGNTBAAMODPC-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50401542   

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
Excitatory amino acid transporter 1 (Homo sapiens (Human))	BDBM50401542 (CHEMBL2207075) Show SMILES CCN(CC)c1ccc2c(C)c(-c3ccc(cc3)C3C(C#N)C(=N)OC4=C3C(=O)CC(C4)c3ccccc3)c(=O)oc2c1 |c:26| Show InChI InChI=1S/C36H33N3O4/c1-4-39(5-2)26-15-16-27-21(3)32(36(41)43-30(27)19-26)23-11-13-24(14-12-23)33-28(20-37)35(38)42-31-18-25(17-29(40)34(31)33)22-9-7-6-8-10-22/h6-16,19,25,28,33,38H,4-5,17-18H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.16E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Inhibition of [3H]-D-aspartate uptake at human EAAT1 expressed in HEK293 cells after 6 mins by scintillation counting				Bioorg Med Chem 20: 6831-9 (2012) Article DOI: 10.1016/j.bmc.2012.09.049 BindingDB Entry DOI: 10.7270/Q25B03PT
					More data for this Ligand-Target Pair
Excitatory amino acid transporter 1 (Homo sapiens (Human))	BDBM50401542 (CHEMBL2207075) Show SMILES CCN(CC)c1ccc2c(C)c(-c3ccc(cc3)C3C(C#N)C(=N)OC4=C3C(=O)CC(C4)c3ccccc3)c(=O)oc2c1 |c:26| Show InChI InChI=1S/C36H33N3O4/c1-4-39(5-2)26-15-16-27-21(3)32(36(41)43-30(27)19-26)23-11-13-24(14-12-23)33-28(20-37)35(38)42-31-18-25(17-29(40)34(31)33)22-9-7-6-8-10-22/h6-16,19,25,28,33,38H,4-5,17-18H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Inhibition of [3H]-D-aspartate uptake at human EAAT1 expressed in HEK293 cells after 6 mins by scintillation counting				Bioorg Med Chem 20: 6831-9 (2012) Article DOI: 10.1016/j.bmc.2012.09.049 BindingDB Entry DOI: 10.7270/Q25B03PT
					More data for this Ligand-Target Pair
Excitatory amino acid transporter 2 (Homo sapiens (Human))	BDBM50401542 (CHEMBL2207075) Show SMILES CCN(CC)c1ccc2c(C)c(-c3ccc(cc3)C3C(C#N)C(=N)OC4=C3C(=O)CC(C4)c3ccccc3)c(=O)oc2c1 |c:26| Show InChI InChI=1S/C36H33N3O4/c1-4-39(5-2)26-15-16-27-21(3)32(36(41)43-30(27)19-26)23-11-13-24(14-12-23)33-28(20-37)35(38)42-31-18-25(17-29(40)34(31)33)22-9-7-6-8-10-22/h6-16,19,25,28,33,38H,4-5,17-18H2,1-3H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Inhibition of [3H]-D-aspartate uptake at human EAAT2 expressed in HEK293 cells after 6 mins by scintillation counting				Bioorg Med Chem 20: 6831-9 (2012) Article DOI: 10.1016/j.bmc.2012.09.049 BindingDB Entry DOI: 10.7270/Q25B03PT
					More data for this Ligand-Target Pair
Excitatory amino acid transporter 3 (Homo sapiens (Human))	BDBM50401542 (CHEMBL2207075) Show SMILES CCN(CC)c1ccc2c(C)c(-c3ccc(cc3)C3C(C#N)C(=N)OC4=C3C(=O)CC(C4)c3ccccc3)c(=O)oc2c1 |c:26| Show InChI InChI=1S/C36H33N3O4/c1-4-39(5-2)26-15-16-27-21(3)32(36(41)43-30(27)19-26)23-11-13-24(14-12-23)33-28(20-37)35(38)42-31-18-25(17-29(40)34(31)33)22-9-7-6-8-10-22/h6-16,19,25,28,33,38H,4-5,17-18H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Inhibition of [3H]-D-aspartate uptake at human EAAT3 expressed in HEK293 cells after 6 mins by scintillation counting				Bioorg Med Chem 20: 6831-9 (2012) Article DOI: 10.1016/j.bmc.2012.09.049 BindingDB Entry DOI: 10.7270/Q25B03PT
					More data for this Ligand-Target Pair