BDBM50401540 CHEMBL2207073

SMILES: CCN(CC)c1ccc2c(cc(=O)oc2c1)C1CC(=O)C2=C(C1)OC(=N)C(C#N)C2C

InChI Key: InChIKey=SLCOSLGWNRBPCC-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 = 50401540   

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))	BDBM50401540 (CHEMBL2207073) Show SMILES CCN(CC)c1ccc2c(cc(=O)oc2c1)C1CC(=O)C2=C(C1)OC(=N)C(C#N)C2C |c:22| Show InChI InChI=1S/C24H25N3O4/c1-4-27(5-2)15-6-7-16-17(11-22(29)30-20(16)10-15)14-8-19(28)23-13(3)18(12-25)24(26)31-21(23)9-14/h6-7,10-11,13-14,18,26H,4-5,8-9H2,1-3H3	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	1.41E+4	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))	BDBM50401540 (CHEMBL2207073) Show SMILES CCN(CC)c1ccc2c(cc(=O)oc2c1)C1CC(=O)C2=C(C1)OC(=N)C(C#N)C2C |c:22| Show InChI InChI=1S/C24H25N3O4/c1-4-27(5-2)15-6-7-16-17(11-22(29)30-20(16)10-15)14-8-19(28)23-13(3)18(12-25)24(26)31-21(23)9-14/h6-7,10-11,13-14,18,26H,4-5,8-9H2,1-3H3	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	1.40E+4	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))	BDBM50401540 (CHEMBL2207073) Show SMILES CCN(CC)c1ccc2c(cc(=O)oc2c1)C1CC(=O)C2=C(C1)OC(=N)C(C#N)C2C |c:22| Show InChI InChI=1S/C24H25N3O4/c1-4-27(5-2)15-6-7-16-17(11-22(29)30-20(16)10-15)14-8-19(28)23-13(3)18(12-25)24(26)31-21(23)9-14/h6-7,10-11,13-14,18,26H,4-5,8-9H2,1-3H3	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))	BDBM50401540 (CHEMBL2207073) Show SMILES CCN(CC)c1ccc2c(cc(=O)oc2c1)C1CC(=O)C2=C(C1)OC(=N)C(C#N)C2C |c:22| Show InChI InChI=1S/C24H25N3O4/c1-4-27(5-2)15-6-7-16-17(11-22(29)30-20(16)10-15)14-8-19(28)23-13(3)18(12-25)24(26)31-21(23)9-14/h6-7,10-11,13-14,18,26H,4-5,8-9H2,1-3H3	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