BDBM50355329 CHEMBL1835336

SMILES: NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O

InChI Key: InChIKey=DRCLPFURMHGQPC-UHFFFAOYSA-N

Data: 6 KI  1 IC50

PDB links: 2 PDB IDs match this monomer.

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 7 hits for monomerid = 50355329   

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
Glutamate receptor ionotropic, kainate 1 (RAT)	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	PDB Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]-(2S,4R)-4-methylglutamic acid from full length recombinant rat GluKK1(Q)1b receptor expressed in sf9 cells by liquid scintillati...				Bioorg Med Chem 22: 5368-77 (2014) Article DOI: 10.1016/j.bmc.2014.07.045 BindingDB Entry DOI: 10.7270/Q2TM7CXK
					More data for this Ligand-Target Pair				3D Structure (crystal)
GRIA2 (Homo sapiens (Human))	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	PDB Article PubMed	3.15E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]AMPA from recombinant GluA2 S1S2J soluble ligand binding domain				J Med Chem 54: 7289-98 (2011) Article DOI: 10.1021/jm200862h BindingDB Entry DOI: 10.7270/Q2QC03WT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glutamate receptor 1 (Rattus norvegicus (Rat))	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	Article PubMed	6.87E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]AMPA from recombinant rat GluA1 flop isoform receptor expressed in Sf9 insect cell membrane				J Med Chem 54: 7289-98 (2011) Article DOI: 10.1021/jm200862h BindingDB Entry DOI: 10.7270/Q2QC03WT
					More data for this Ligand-Target Pair
Glutamate receptor ionotropic, kainate (Rattus norvegicus)	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	Article PubMed	1.44E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]-(2S,4R)-4-methylglutamic acid from full length recombinant rat GluK3 receptor expressed in sf9 cells by liquid scintillation cou...				Bioorg Med Chem 22: 5368-77 (2014) Article DOI: 10.1016/j.bmc.2014.07.045 BindingDB Entry DOI: 10.7270/Q2TM7CXK
					More data for this Ligand-Target Pair
Glutamate receptor ionotropic, AMPA 4 (Rattus norvegicus)	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	PDB Article PubMed	2.04E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]AMPA from recombinant rat GluA4 flop isoform receptor expressed in Sf9 insect cell membrane				J Med Chem 54: 7289-98 (2011) Article DOI: 10.1021/jm200862h BindingDB Entry DOI: 10.7270/Q2QC03WT
					More data for this Ligand-Target Pair				3D Structure (crystal)
GRIA3 (RAT)	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	PDB Article PubMed	2.27E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]AMPA from recombinant rat GluA3 flop isoform receptor expressed in Sf9 insect cell membrane				J Med Chem 54: 7289-98 (2011) Article DOI: 10.1021/jm200862h BindingDB Entry DOI: 10.7270/Q2QC03WT
					More data for this Ligand-Target Pair				3D Structure (crystal)
GRIA3 (RAT)	BDBM50355329 (CHEMBL1835336) Show SMILES NC(Cc1cc(Cl)c(cc1CCC(O)=O)[N+]([O-])=O)C(O)=O Show InChI InChI=1S/C12H13ClN2O6/c13-8-3-7(4-9(14)12(18)19)6(1-2-11(16)17)5-10(8)15(20)21/h3,5,9H,1-2,4,14H2,(H,16,17)(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at recombinant rat GluA3 flip isoform receptor expressed in Xenopus laevis oocytes assessed as inhibition of glutamate-induced cu...				J Med Chem 54: 7289-98 (2011) Article DOI: 10.1021/jm200862h BindingDB Entry DOI: 10.7270/Q2QC03WT
					More data for this Ligand-Target Pair				3D Structure (crystal)