BDBM50231889 3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-1H-indole-6-carboxylic acid::CHEMBL250740

SMILES: CCCCCc1c(CO)c2cc(C)c(cc2n1CCc1ccccc1)C(O)=O

InChI Key: InChIKey=CCLIAIJADYWFFL-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 = 50231889   

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))	BDBM50231889 (3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-1H...) Show SMILES CCCCCc1c(CO)c2cc(C)c(cc2n1CCc1ccccc1)C(O)=O Show InChI InChI=1S/C24H29NO3/c1-3-4-6-11-22-21(16-26)20-14-17(2)19(24(27)28)15-23(20)25(22)13-12-18-9-7-5-8-10-18/h5,7-10,14-15,26H,3-4,6,11-13,16H2,1-2H3,(H,27,28)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+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))	BDBM50231889 (3-(hydroxymethyl)-5-methyl-2-pentyl-1-phenethyl-1H...) Show SMILES CCCCCc1c(CO)c2cc(C)c(cc2n1CCc1ccccc1)C(O)=O Show InChI InChI=1S/C24H29NO3/c1-3-4-6-11-22-21(16-26)20-14-17(2)19(24(27)28)15-23(20)25(22)13-12-18-9-7-5-8-10-18/h5,7-10,14-15,26H,3-4,6,11-13,16H2,1-2H3,(H,27,28)	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	2.80E+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 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