BDBM44180 1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-4-methyl-1,4-dihydro-pyrrolo[3,2-b]pyrrole-2-carboxylic acid ethyl ester::1-methyl-4-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester::4-[2-(4-benzylpiperidino)-2-keto-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylic acid ethyl ester::MLS000068235::SMR000008292::cid_651846::ethyl 1-methyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate::ethyl 4-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-1-methylpyrrolo[3,2-b]pyrrole-5-carboxylate

SMILES: CCOC(=O)c1cc2n(C)ccc2n1CC(=O)N1CCC(Cc2ccccc2)CC1

InChI Key: InChIKey=DQYILCRYEVYZBN-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 = 44180   

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
electroneutral potassium-chloride cotransporter KCC2 (Homo sapiens (Human))	BDBM44180 (1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-4-meth...) Show SMILES CCOC(=O)c1cc2n(C)ccc2n1CC(=O)N1CCC(Cc2ccccc2)CC1 Show InChI InChI=1S/C24H29N3O3/c1-3-30-24(29)22-16-21-20(11-12-25(21)2)27(22)17-23(28)26-13-9-19(10-14-26)15-18-7-5-4-6-8-18/h4-8,11-12,16,19H,3,9-10,13-15,17H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.08E+4	n/a	n/a	n/a	n/a
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Curated by PubChem BioAssay					Assay Description Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2M32T6M
					More data for this Ligand-Target Pair
electroneutral potassium-chloride cotransporter KCC2 (Homo sapiens (Human))	BDBM44180 (1-[2-(4-Benzyl-piperidin-1-yl)-2-oxo-ethyl]-4-meth...) Show SMILES CCOC(=O)c1cc2n(C)ccc2n1CC(=O)N1CCC(Cc2ccccc2)CC1 Show InChI InChI=1S/C24H29N3O3/c1-3-30-24(29)22-16-21-20(11-12-25(21)2)27(22)17-23(28)26-13-9-19(10-14-26)15-18-7-5-4-6-8-18/h4-8,11-12,16,19H,3,9-10,13-15,17H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	7.58E+3	n/a	n/a	n/a	n/a
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Curated by PubChem BioAssay					Assay Description Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2Q52N1X
					More data for this Ligand-Target Pair