BDBM50225107 CHEMBL49914

SMILES: CCCc1c(O)c(ccc1OCCCOc1ccc2ccc(OCC(O)=O)cc2c1C(C)=O)C(C)=O

InChI Key: InChIKey=HNPGZXUDAMBXBD-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50225107   

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
Cysteinyl leukotriene receptor 1/2 (Homo sapiens (Human))	BDBM50225107 (CHEMBL49914) Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc2ccc(OCC(O)=O)cc2c1C(C)=O)C(C)=O Show InChI InChI=1S/C28H30O8/c1-4-6-22-24(12-10-21(17(2)29)28(22)33)34-13-5-14-35-25-11-8-19-7-9-20(36-16-26(31)32)15-23(19)27(25)18(3)30/h7-12,15,33H,4-6,13-14,16H2,1-3H3,(H,31,32)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibition of SRS-A-induced contractions in guinea pig ileum				J Med Chem 30: 173-8 (1987) BindingDB Entry DOI: 10.7270/Q2D220TJ
					More data for this Ligand-Target Pair