BDBM50231893 2-(4-carboxybutyl)-3-(hydroxymethyl)-5-methyl-1-phenethyl-1H-indole-6-carboxylic acid::CHEMBL403297

SMILES: Cc1cc2c(CO)c(CCCCC(O)=O)n(CCc3ccccc3)c2cc1C(O)=O

InChI Key: InChIKey=GSHUXALZYZULQD-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50231893   

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
Cystic fibrosis transmembrane conductance regulator (Homo sapiens (Human))	BDBM50231893 (2-(4-carboxybutyl)-3-(hydroxymethyl)-5-methyl-1-ph...) Show SMILES Cc1cc2c(CO)c(CCCCC(O)=O)n(CCc3ccccc3)c2cc1C(O)=O Show InChI InChI=1S/C24H27NO5/c1-16-13-19-20(15-26)21(9-5-6-10-23(27)28)25(22(19)14-18(16)24(29)30)12-11-17-7-3-2-4-8-17/h2-4,7-8,13-14,26H,5-6,9-12,15H2,1H3,(H,27,28)(H,29,30)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
St. Jude Children's Research Hospital Curated by ChEMBL					Assay Description Binding affinity to GST tagged human CFTR PDZ2 domain				Bioorg Med Chem Lett 18: 942-5 (2008) Article DOI: 10.1016/j.bmcl.2007.12.038 BindingDB Entry DOI: 10.7270/Q2DJ5FC2
					More data for this Ligand-Target Pair
Beta-2 adrenergic receptor (Homo sapiens (Human))	BDBM50231893 (2-(4-carboxybutyl)-3-(hydroxymethyl)-5-methyl-1-ph...) Show SMILES Cc1cc2c(CO)c(CCCCC(O)=O)n(CCc3ccccc3)c2cc1C(O)=O Show InChI InChI=1S/C24H27NO5/c1-16-13-19-20(15-26)21(9-5-6-10-23(27)28)25(22(19)14-18(16)24(29)30)12-11-17-7-3-2-4-8-17/h2-4,7-8,13-14,26H,5-6,9-12,15H2,1H3,(H,27,28)(H,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
St. Jude Children's Research Hospital Curated by ChEMBL					Assay Description Binding affinity to GST tagged human beta 2 adrenergic receptor PDZ1 domain				Bioorg Med Chem Lett 18: 942-5 (2008) Article DOI: 10.1016/j.bmcl.2007.12.038 BindingDB Entry DOI: 10.7270/Q2DJ5FC2
					More data for this Ligand-Target Pair