BDBM50226777 CHEMBL167597

SMILES: CCCc1c(OCc2ccc(cc2)-c2nn[nH]n2)ccc(C(C)=O)c1O

InChI Key: InChIKey=YPUUTNJQPHSGDA-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 = 50226777   

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))	BDBM50226777 (CHEMBL167597) Show SMILES CCCc1c(OCc2ccc(cc2)-c2nn[nH]n2)ccc(C(C)=O)c1O Show InChI InChI=1S/C19H20N4O3/c1-3-4-16-17(10-9-15(12(2)24)18(16)25)26-11-13-5-7-14(8-6-13)19-20-22-23-21-19/h5-10,25H,3-4,11H2,1-2H3,(H,20,21,22,23)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of LTD4-induced contraction in guinea pig ileum				J Med Chem 30: 911-8 (1987) BindingDB Entry DOI: 10.7270/Q25X2B45
					More data for this Ligand-Target Pair